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Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
Imidazoles (1,648)
Thiazoles (686)
Pyrazoles (585)
Triazoles (224)
Isoxazoles (212)
Oxazoles (115)
Thiadiazoles (85)
Oxadiazoles (62)
Dithiazoles (8)

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1

Thermo Scientific Chemicals Thiazolyl Blue tetrazolium bromide, 98%

CAS: 298-93-1 Formula molecolare: C18H16BrN5S Molecular Weight (g/mol): 414.33 Numero MDL: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Sinonimo: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 IUPAC Name: 2-(3,5-diphenyltetrazol-2-ium-2-yl)-4,5-dimethyl-1,3-thiazole;bromide SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1

EDGE
Sinonimo thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i
Numero MDL MFCD00011964,MFCD00066662
PubChem CID 64965
Formula molecolare C18H16BrN5S
CAS 298-93-1
Molecular Weight (g/mol) 414.33
ChEBI CHEBI:53233
SMILES [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2-(3,5-diphenyltetrazol-2-ium-2-yl)-4,5-dimethyl-1,3-thiazole;bromide
InChI Key AZKSAVLVSZKNRD-UHFFFAOYSA-M
2

Thiazolyl blue tetrazolium bromide, 98%

CAS: 298-93-1 Formula molecolare: C18H16BrN5S Molecular Weight (g/mol): 414.33 Numero MDL: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Sinonimo: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1

EDGE
Sinonimo thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i
Numero MDL MFCD00011964,MFCD00066662
PubChem CID 64965
Formula molecolare C18H16BrN5S
CAS 298-93-1
Molecular Weight (g/mol) 414.33
ChEBI CHEBI:53233
SMILES [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
InChI Key AZKSAVLVSZKNRD-UHFFFAOYSA-M
3

1,2,4-Triazole, 99%

CAS: 288-88-0 Formula molecolare: C2H3N3 Molecular Weight (g/mol): 69.067 Numero MDL: MFCD00005228 InChI Key: NSPMIYGKQJPBQR-UHFFFAOYSA-N Sinonimo: 1,2,4-triazole,4h-1,2,4-triazole,pyrrodiazole,s-triazole,1,2,4-1h-triazole,1h-1,2,4-triazol,unii-10ms0y1rdi,1,2,4 triazole,1,2,4-triazol,4h-1,2,4-triazole van PubChem CID: 9257 ChEBI: CHEBI:35550 IUPAC Name: 1H-1,2,4-triazole SMILES: C1=NC=NN1

EDGE
Sinonimo 1,2,4-triazole,4h-1,2,4-triazole,pyrrodiazole,s-triazole,1,2,4-1h-triazole,1h-1,2,4-triazol,unii-10ms0y1rdi,1,2,4 triazole,1,2,4-triazol,4h-1,2,4-triazole van
Numero MDL MFCD00005228
PubChem CID 9257
Formula molecolare C2H3N3
CAS 288-88-0
Molecular Weight (g/mol) 69.067
ChEBI CHEBI:35550
SMILES C1=NC=NN1
IUPAC Name 1H-1,2,4-triazole
InChI Key NSPMIYGKQJPBQR-UHFFFAOYSA-N
4

1-Butyl-3-methylimidazolium hexafluorophosphate, 98+%

CAS: 174501-64-5 Formula molecolare: C8H15F6N2P Molecular Weight (g/mol): 284.19 Numero MDL: MFCD03093295 InChI Key: IXQYBUDWDLYNMA-UHFFFAOYSA-N Sinonimo: 1-butyl-3-methylimidazolium hexafluorophosphate,1-butyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate v,unii-zge3n4o8q9,1-butyl-3-methylimidazoliumhexafluorophosphate,1-n-butyl-3-methylimidazolium hexafluorophosphate,zge3n4o8q9,butylmethylimidazolium hexafluorophosphate,1-methyl-3-butylimidazolium hexafluorophosphate,bmim pf6,c4mim hexafluorophosphate PubChem CID: 2734174 SMILES: F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1

EDGE
Sinonimo 1-butyl-3-methylimidazolium hexafluorophosphate,1-butyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate v,unii-zge3n4o8q9,1-butyl-3-methylimidazoliumhexafluorophosphate,1-n-butyl-3-methylimidazolium hexafluorophosphate,zge3n4o8q9,butylmethylimidazolium hexafluorophosphate,1-methyl-3-butylimidazolium hexafluorophosphate,bmim pf6,c4mim hexafluorophosphate
Numero MDL MFCD03093295
PubChem CID 2734174
Formula molecolare C8H15F6N2P
CAS 174501-64-5
Molecular Weight (g/mol) 284.19
SMILES F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1
InChI Key IXQYBUDWDLYNMA-UHFFFAOYSA-N
5

1-Ethyl-3-methylimidazolium bromide, 98+%

CAS: 65039-08-9 Formula molecolare: C6H11BrN2 Molecular Weight (g/mol): 191.07 Numero MDL: MFCD03427610 InChI Key: GWQYPLXGJIXMMV-UHFFFAOYSA-M Sinonimo: 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br PubChem CID: 2734235 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;bromide SMILES: [Br-].CCN1C=C[N+](C)=C1

Sinonimo 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br
Numero MDL MFCD03427610
PubChem CID 2734235
Formula molecolare C6H11BrN2
CAS 65039-08-9
Molecular Weight (g/mol) 191.07
SMILES [Br-].CCN1C=C[N+](C)=C1
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;bromide
InChI Key GWQYPLXGJIXMMV-UHFFFAOYSA-M
6

Xanthane hydride, Thermo Scientific Chemicals

CAS: 6846-35-1 Formula molecolare: C2H2N2S3 Molecular Weight (g/mol): 150.23 InChI Key: YWZHEXZIISFIDA-UHFFFAOYSA-N IUPAC Name: 5-amino-3H-1,2,4-dithiazole-3-thione SMILES: NC1=NC(=S)SS1

Formula molecolare C2H2N2S3
CAS 6846-35-1
Molecular Weight (g/mol) 150.23
SMILES NC1=NC(=S)SS1
IUPAC Name 5-amino-3H-1,2,4-dithiazole-3-thione
InChI Key YWZHEXZIISFIDA-UHFFFAOYSA-N
7

1,1'-Carbonyldiimidazole, 97%

CAS: 530-62-1 Formula molecolare: C7H6N4O Molecular Weight (g/mol): 162.15 Numero MDL: MFCD00005286 InChI Key: PFKFTWBEEFSNDU-UHFFFAOYSA-N Sinonimo: 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole PubChem CID: 68263 SMILES: O=C(N1C=CN=C1)N1C=CN=C1

Sinonimo 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole
Numero MDL MFCD00005286
PubChem CID 68263
Formula molecolare C7H6N4O
CAS 530-62-1
Molecular Weight (g/mol) 162.15
SMILES O=C(N1C=CN=C1)N1C=CN=C1
InChI Key PFKFTWBEEFSNDU-UHFFFAOYSA-N
8

1-Methylimidazole, 99%

CAS: 616-47-7 Formula molecolare: C4H6N2 Molecular Weight (g/mol): 82.11 Numero MDL: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N Sinonimo: 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole PubChem CID: 1390 ChEBI: CHEBI:113454 IUPAC Name: 1-methylimidazole SMILES: CN1C=CN=C1

Sinonimo 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
Numero MDL MFCD00005292
PubChem CID 1390
Formula molecolare C4H6N2
CAS 616-47-7
Molecular Weight (g/mol) 82.11
ChEBI CHEBI:113454
SMILES CN1C=CN=C1
IUPAC Name 1-methylimidazole
InChI Key MCTWTZJPVLRJOU-UHFFFAOYSA-N
9

1-Methylimidazole, 99%

CAS: 616-47-7 Formula molecolare: C4H6N2 Molecular Weight (g/mol): 82.11 Numero MDL: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N Sinonimo: 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole PubChem CID: 1390 ChEBI: CHEBI:113454 SMILES: CN1C=CN=C1

Sinonimo 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
Numero MDL MFCD00005292
PubChem CID 1390
Formula molecolare C4H6N2
CAS 616-47-7
Molecular Weight (g/mol) 82.11
ChEBI CHEBI:113454
SMILES CN1C=CN=C1
InChI Key MCTWTZJPVLRJOU-UHFFFAOYSA-N
10

1H-Benzotriazole, 99%

CAS: 95-14-7 Formula molecolare: C6H5N3 Molecular Weight (g/mol): 119.127 Numero MDL: MFCD00005699 InChI Key: QRUDEWIWKLJBPS-UHFFFAOYSA-N Sinonimo: 1h-benzotriazole,benzotriazole,1,2,3-benzotriazole,1h-benzo d 1,2,3 triazole,azimidobenzene,1h-1,2,3-benzotriazole,aziminobenzene,benztriazole,benzene azimide,benzisotriazole PubChem CID: 7220 ChEBI: CHEBI:75331 IUPAC Name: 2H-benzotriazole SMILES: C1=CC2=NNN=C2C=C1

Sinonimo 1h-benzotriazole,benzotriazole,1,2,3-benzotriazole,1h-benzo d 1,2,3 triazole,azimidobenzene,1h-1,2,3-benzotriazole,aziminobenzene,benztriazole,benzene azimide,benzisotriazole
Numero MDL MFCD00005699
PubChem CID 7220
Formula molecolare C6H5N3
CAS 95-14-7
Molecular Weight (g/mol) 119.127
ChEBI CHEBI:75331
SMILES C1=CC2=NNN=C2C=C1
IUPAC Name 2H-benzotriazole
InChI Key QRUDEWIWKLJBPS-UHFFFAOYSA-N
11

4-Amino-3-hydrazino-5-mercapto-1,2,4-triazole, 99+%, Thermo Scientific Chemicals

CAS: 1750-12-5 Formula molecolare: C2H6N6S Molecular Weight (g/mol): 146.172 Numero MDL: MFCD00003098 InChI Key: RDIMQHBOTMWMJA-UHFFFAOYSA-N Sinonimo: 4-amino-3-hydrazino-5-mercapto-1,2,4-triazole,purpald,4-amino-3-hydrazino-1,2,4-triazol-5-thiol,1,2,4-triazolidin-3-one, 4-amino-5-thioxo-, hydrazone,purpald r,4-amino-5-hydrazino-1,2,4-triazole-3-thiol,1,2,4-triazolidin-3-one, 4-amino-5-thioxo-, 3-hydrazone,4-amino-5-hydrazinyl-4h-1,2,4-triazole-3-thiol,3h-1,2,4-triazole-3-thione, 4-amino-5-hydrazinyl-2,4-dihydro,4-amino-5-hydrazinyl-1,2,4-triazole-3-thiol PubChem CID: 2723946 IUPAC Name: 4-amino-3-hydrazinyl-1H-1,2,4-triazole-5-thione SMILES: C1(=S)NN=C(N1N)NN

Sinonimo 4-amino-3-hydrazino-5-mercapto-1,2,4-triazole,purpald,4-amino-3-hydrazino-1,2,4-triazol-5-thiol,1,2,4-triazolidin-3-one, 4-amino-5-thioxo-, hydrazone,purpald r,4-amino-5-hydrazino-1,2,4-triazole-3-thiol,1,2,4-triazolidin-3-one, 4-amino-5-thioxo-, 3-hydrazone,4-amino-5-hydrazinyl-4h-1,2,4-triazole-3-thiol,3h-1,2,4-triazole-3-thione, 4-amino-5-hydrazinyl-2,4-dihydro,4-amino-5-hydrazinyl-1,2,4-triazole-3-thiol
Numero MDL MFCD00003098
PubChem CID 2723946
Formula molecolare C2H6N6S
CAS 1750-12-5
Molecular Weight (g/mol) 146.172
SMILES C1(=S)NN=C(N1N)NN
IUPAC Name 4-amino-3-hydrazinyl-1H-1,2,4-triazole-5-thione
InChI Key RDIMQHBOTMWMJA-UHFFFAOYSA-N
12

1H-Benzotriazole, 99%

CAS: 95-14-7 Formula molecolare: C6H5N3 Molecular Weight (g/mol): 119.13 Numero MDL: MFCD00005699 InChI Key: QRUDEWIWKLJBPS-UHFFFAOYSA-N Sinonimo: 1h-benzotriazole,benzotriazole,1,2,3-benzotriazole,1h-benzo d 1,2,3 triazole,azimidobenzene,1h-1,2,3-benzotriazole,aziminobenzene,benztriazole,benzene azimide,benzisotriazole PubChem CID: 7220 ChEBI: CHEBI:75331 IUPAC Name: 2H-benzotriazole SMILES: C1=CC2=NNN=C2C=C1

Sinonimo 1h-benzotriazole,benzotriazole,1,2,3-benzotriazole,1h-benzo d 1,2,3 triazole,azimidobenzene,1h-1,2,3-benzotriazole,aziminobenzene,benztriazole,benzene azimide,benzisotriazole
Numero MDL MFCD00005699
PubChem CID 7220
Formula molecolare C6H5N3
CAS 95-14-7
Molecular Weight (g/mol) 119.13
ChEBI CHEBI:75331
SMILES C1=CC2=NNN=C2C=C1
IUPAC Name 2H-benzotriazole
InChI Key QRUDEWIWKLJBPS-UHFFFAOYSA-N
13

Metronidazole, 99%

CAS: 443-48-1 Formula molecolare: C6H9N3O3 Molecular Weight (g/mol): 171.156 Numero MDL: MFCD00009750 InChI Key: VAOCPAMSLUNLGC-UHFFFAOYSA-N Sinonimo: metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol PubChem CID: 4173 ChEBI: CHEBI:6909 IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanol SMILES: CC1=NC=C(N1CCO)[N+](=O)[O-]

Sinonimo metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol
Numero MDL MFCD00009750
PubChem CID 4173
Formula molecolare C6H9N3O3
CAS 443-48-1
Molecular Weight (g/mol) 171.156
ChEBI CHEBI:6909
SMILES CC1=NC=C(N1CCO)[N+](=O)[O-]
IUPAC Name 2-(2-methyl-5-nitroimidazol-1-yl)ethanol
InChI Key VAOCPAMSLUNLGC-UHFFFAOYSA-N
14

1,2,4-1H-Triazole, 99.5%

CAS: 288-88-0 Formula molecolare: C2H3N3 Molecular Weight (g/mol): 69.06 Numero MDL: MFCD00005228 InChI Key: NSPMIYGKQJPBQR-UHFFFAOYSA-N Sinonimo: 1,2,4-triazole,4h-1,2,4-triazole,pyrrodiazole,s-triazole,1,2,4-1h-triazole,1h-1,2,4-triazol,unii-10ms0y1rdi,1,2,4 triazole,1,2,4-triazol,4h-1,2,4-triazole van PubChem CID: 9257 ChEBI: CHEBI:35550 IUPAC Name: 1H-1,2,4-triazole SMILES: C1=NC=NN1

Sinonimo 1,2,4-triazole,4h-1,2,4-triazole,pyrrodiazole,s-triazole,1,2,4-1h-triazole,1h-1,2,4-triazol,unii-10ms0y1rdi,1,2,4 triazole,1,2,4-triazol,4h-1,2,4-triazole van
Numero MDL MFCD00005228
PubChem CID 9257
Formula molecolare C2H3N3
CAS 288-88-0
Molecular Weight (g/mol) 69.06
ChEBI CHEBI:35550
SMILES C1=NC=NN1
IUPAC Name 1H-1,2,4-triazole
InChI Key NSPMIYGKQJPBQR-UHFFFAOYSA-N
15

1,1'-Carbonyldiimidazole, 97%

CAS: 530-62-1 Formula molecolare: C7H6N4O Molecular Weight (g/mol): 162.15 Numero MDL: MFCD00005286 InChI Key: PFKFTWBEEFSNDU-UHFFFAOYSA-N Sinonimo: 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole PubChem CID: 68263 IUPAC Name: di(imidazol-1-yl)methanone SMILES: O=C(N1C=CN=C1)N1C=CN=C1

Sinonimo 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole
Numero MDL MFCD00005286
PubChem CID 68263
Formula molecolare C7H6N4O
CAS 530-62-1
Molecular Weight (g/mol) 162.15
SMILES O=C(N1C=CN=C1)N1C=CN=C1
IUPAC Name di(imidazol-1-yl)methanone
InChI Key PFKFTWBEEFSNDU-UHFFFAOYSA-N