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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-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

Sulfisoxazole, 99%, Thermo Scientific Chemicals

CAS: 127-69-5 Formula molecolare: C11H13N3O3S Molecular Weight (g/mol): 267.3 InChI Key: NHUHCSRWZMLRLA-UHFFFAOYSA-N Sinonimo: sulfisoxazole,sulfafurazole,sulphafurazole,sulfisoxazol,sulfafurazol,sulfaisoxazole,sulfofurazole,sulfisoxasole,sulphaisoxazole,sulfadimethylisoxazole PubChem CID: 5344 ChEBI: CHEBI:102484 IUPAC Name: 4-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide SMILES: CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N

Sinonimo sulfisoxazole,sulfafurazole,sulphafurazole,sulfisoxazol,sulfafurazol,sulfaisoxazole,sulfofurazole,sulfisoxasole,sulphaisoxazole,sulfadimethylisoxazole
PubChem CID 5344
Formula molecolare C11H13N3O3S
CAS 127-69-5
Molecular Weight (g/mol) 267.3
ChEBI CHEBI:102484
SMILES CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N
IUPAC Name 4-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide
InChI Key NHUHCSRWZMLRLA-UHFFFAOYSA-N
7

Thermo Scientific Chemicals Metronidazole, 99%

CAS: 443-48-1 Formula molecolare: C6H9N3O3 Molecular Weight (g/mol): 171.16 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) 171.16
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
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-Ethyl-3-methylimidazolium ethyl sulfate, 99%

CAS: 342573-75-5 Formula molecolare: C8H16N2O4S Molecular Weight (g/mol): 236.286 Numero MDL: MFCD06798189 InChI Key: VRFOKYHDLYBVAL-UHFFFAOYSA-M Sinonimo: 1-ethyl-3-methylimidazolium ethyl sulfate,1-ethyl-3-methylimidazolium ethylsulfate,1-ethyl-3-methyl-1h-imidazol-3-ium ethyl sulfate,basionics™ lq 01,dsstox_cid_29130,dsstox_rid_83349,dsstox_gsid_49274,ksc221o0f,1h-imidazolium, 3-ethyl-1-methyl-, ethyl sulfate 1:1,1-ethyl-3-me-thylimidazolium ethylsulfate PubChem CID: 12095229 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;ethyl sulfate SMILES: CCN1C=C[N+](=C1)C.CCOS(=O)(=O)[O-]

Sinonimo 1-ethyl-3-methylimidazolium ethyl sulfate,1-ethyl-3-methylimidazolium ethylsulfate,1-ethyl-3-methyl-1h-imidazol-3-ium ethyl sulfate,basionics™ lq 01,dsstox_cid_29130,dsstox_rid_83349,dsstox_gsid_49274,ksc221o0f,1h-imidazolium, 3-ethyl-1-methyl-, ethyl sulfate 1:1,1-ethyl-3-me-thylimidazolium ethylsulfate
Numero MDL MFCD06798189
PubChem CID 12095229
Formula molecolare C8H16N2O4S
CAS 342573-75-5
Molecular Weight (g/mol) 236.286
SMILES CCN1C=C[N+](=C1)C.CCOS(=O)(=O)[O-]
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;ethyl sulfate
InChI Key VRFOKYHDLYBVAL-UHFFFAOYSA-M
10

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
11

1-Aminobenzotriazole, 98%

CAS: 1614-12-6 Formula molecolare: C6H6N4 Molecular Weight (g/mol): 134.14 Numero MDL: MFCD00132902 InChI Key: JCXKHYLLVKZPKE-UHFFFAOYSA-N Sinonimo: 1-aminobenzotriazole,1h-benzotriazol-1-amine,1h-benzo d 1,2,3 triazol-1-amine,1-benzotriazolamine,1-abtz,1h-1,2,3-benzotriazol-1-amine,1h-1,2,3-benzotriazol-1-ylamine,1,2,3-benzotriazol-1-amine,benzotriazolylamine,1-benzotriazolylamine PubChem CID: 1367 IUPAC Name: benzotriazol-1-amine SMILES: C1=CC=C2C(=C1)N=NN2N

Sinonimo 1-aminobenzotriazole,1h-benzotriazol-1-amine,1h-benzo d 1,2,3 triazol-1-amine,1-benzotriazolamine,1-abtz,1h-1,2,3-benzotriazol-1-amine,1h-1,2,3-benzotriazol-1-ylamine,1,2,3-benzotriazol-1-amine,benzotriazolylamine,1-benzotriazolylamine
Numero MDL MFCD00132902
PubChem CID 1367
Formula molecolare C6H6N4
CAS 1614-12-6
Molecular Weight (g/mol) 134.14
SMILES C1=CC=C2C(=C1)N=NN2N
IUPAC Name benzotriazol-1-amine
InChI Key JCXKHYLLVKZPKE-UHFFFAOYSA-N
12

4-Amino-4H-1,2,4-triazole, 99%

CAS: 584-13-4 Formula molecolare: C2H4N4 Molecular Weight (g/mol): 84.08 Numero MDL: MFCD00003099 InChI Key: FMCUPJKTGNBGEC-UHFFFAOYSA-N Sinonimo: 4-amino-1,2,4-triazole,4-amino-4h-1,2,4-triazole,4h-1,2,4-triazol-4-amine,1-amino-1,3,4-triazole,4h-1,2,4-triazole, 4-amino,1-amino-1h-1,3,4-triazole,4-amino-1,2,4 4h-triazole,4h-1,2,4-triazol-4-ylamine,1-amino-1,4-triazole,4-amino-1,4-triazole PubChem CID: 11432 IUPAC Name: 1,2,4-triazol-4-amine SMILES: C1=NN=CN1N

Sinonimo 4-amino-1,2,4-triazole,4-amino-4h-1,2,4-triazole,4h-1,2,4-triazol-4-amine,1-amino-1,3,4-triazole,4h-1,2,4-triazole, 4-amino,1-amino-1h-1,3,4-triazole,4-amino-1,2,4 4h-triazole,4h-1,2,4-triazol-4-ylamine,1-amino-1,4-triazole,4-amino-1,4-triazole
Numero MDL MFCD00003099
PubChem CID 11432
Formula molecolare C2H4N4
CAS 584-13-4
Molecular Weight (g/mol) 84.08
SMILES C1=NN=CN1N
IUPAC Name 1,2,4-triazol-4-amine
InChI Key FMCUPJKTGNBGEC-UHFFFAOYSA-N
13

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
14

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
15

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