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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

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
3

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
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-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
6

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
7

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
8

1-Vinylimidazole, 99%

CAS: 1072-63-5 Formula molecolare: C5H6N2 Molecular Weight (g/mol): 94.12 Numero MDL: MFCD00005297 InChI Key: OSSNTDFYBPYIEC-UHFFFAOYSA-N Sinonimo: 1-vinylimidazole,1-vinyl-1h-imidazole,n-vinylimidazole,1h-imidazole, 1-ethenyl,lufixan,polyvinylimidazole,poly vinylimidazole,poly n-vinylimidazole,poly 1-vinylimidazole,n-vinylimidazole polymer PubChem CID: 66171 SMILES: C=CN1C=CN=C1

Sinonimo 1-vinylimidazole,1-vinyl-1h-imidazole,n-vinylimidazole,1h-imidazole, 1-ethenyl,lufixan,polyvinylimidazole,poly vinylimidazole,poly n-vinylimidazole,poly 1-vinylimidazole,n-vinylimidazole polymer
Numero MDL MFCD00005297
PubChem CID 66171
Formula molecolare C5H6N2
CAS 1072-63-5
Molecular Weight (g/mol) 94.12
SMILES C=CN1C=CN=C1
InChI Key OSSNTDFYBPYIEC-UHFFFAOYSA-N
9

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
10

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
11

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
12

Thermo Scientific Chemicals Tinidazole

CAS: 19387-91-8 Formula molecolare: C8H13N3O4S Molecular Weight (g/mol): 247.27 Numero MDL: MFCD00057217 InChI Key: HJLSLZFTEKNLFI-UHFFFAOYSA-N IUPAC Name: 1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole SMILES: CCS(=O)(=O)CCN1C(C)=NC=C1[N+]([O-])=O

Numero MDL MFCD00057217
Formula molecolare C8H13N3O4S
CAS 19387-91-8
Molecular Weight (g/mol) 247.27
SMILES CCS(=O)(=O)CCN1C(C)=NC=C1[N+]([O-])=O
IUPAC Name 1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
InChI Key HJLSLZFTEKNLFI-UHFFFAOYSA-N
13

2,5-Dimercapto-1,3,4-thiadiazole, 98%

CAS: 1072-71-5 Formula molecolare: C2H2N2S3 Molecular Weight (g/mol): 150.23 Numero MDL: MFCD00003103 InChI Key: BIGYLAKFCGVRAN-UHFFFAOYSA-N Sinonimo: 1,3,4-thiadiazole-2,5-dithiol,2,5-dimercapto-1,3,4-thiadiazole,bismuthiol i,dimercaptothiadiazole,bismuththiol,2,5-dimercaptothiadiazole,usaf a-8354,bismuthiol,py 61h,bismuththiol i PubChem CID: 2723630 IUPAC Name: 1,3,4-thiadiazolidine-2,5-dithione SMILES: S=C1NNC(=S)S1

Sinonimo 1,3,4-thiadiazole-2,5-dithiol,2,5-dimercapto-1,3,4-thiadiazole,bismuthiol i,dimercaptothiadiazole,bismuththiol,2,5-dimercaptothiadiazole,usaf a-8354,bismuthiol,py 61h,bismuththiol i
Numero MDL MFCD00003103
PubChem CID 2723630
Formula molecolare C2H2N2S3
CAS 1072-71-5
Molecular Weight (g/mol) 150.23
SMILES S=C1NNC(=S)S1
IUPAC Name 1,3,4-thiadiazolidine-2,5-dithione
InChI Key BIGYLAKFCGVRAN-UHFFFAOYSA-N
14

2,4,5-Trimethylthiazole, 98%

CAS: 13623-11-5 Formula molecolare: C6H9NS Molecular Weight (g/mol): 127.205 Numero MDL: MFCD00005332 InChI Key: BAMPVSWRQZNDQC-UHFFFAOYSA-N Sinonimo: 2,4,5-trimethylthiazole,trimethylthiazole,trimethyl thiazole,thiazole, trimethyl,thiazole, 2,4,5-trimethyl,trimethyl-1,3-thiazole,2,4,5-trimethyl thiazole,thiazole, 2,4,5-trimethyl-8ci 9ci,fema no. 3325,trimethyl-thiazole PubChem CID: 61653 ChEBI: CHEBI:78738 IUPAC Name: 2,4,5-trimethyl-1,3-thiazole SMILES: CC1=C(SC(=N1)C)C

Sinonimo 2,4,5-trimethylthiazole,trimethylthiazole,trimethyl thiazole,thiazole, trimethyl,thiazole, 2,4,5-trimethyl,trimethyl-1,3-thiazole,2,4,5-trimethyl thiazole,thiazole, 2,4,5-trimethyl-8ci 9ci,fema no. 3325,trimethyl-thiazole
Numero MDL MFCD00005332
PubChem CID 61653
Formula molecolare C6H9NS
CAS 13623-11-5
Molecular Weight (g/mol) 127.205
ChEBI CHEBI:78738
SMILES CC1=C(SC(=N1)C)C
IUPAC Name 2,4,5-trimethyl-1,3-thiazole
InChI Key BAMPVSWRQZNDQC-UHFFFAOYSA-N
15

1-Ethyl-3-methylimidazolium acetate, 97%

CAS: 143314-17-4 Formula molecolare: C8H14N2O2 Molecular Weight (g/mol): 170.212 Numero MDL: MFCD06798186 InChI Key: XIYUIMLQTKODPS-UHFFFAOYSA-M Sinonimo: 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc PubChem CID: 11658353 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;acetate SMILES: CCN1C=C[N+](=C1)C.CC(=O)[O-]

Sinonimo 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc
Numero MDL MFCD06798186
PubChem CID 11658353
Formula molecolare C8H14N2O2
CAS 143314-17-4
Molecular Weight (g/mol) 170.212
SMILES CCN1C=C[N+](=C1)C.CC(=O)[O-]
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;acetate
InChI Key XIYUIMLQTKODPS-UHFFFAOYSA-M