Azoles
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Potassium 5-Methyl-1,3,4-oxadiazole-2-carboxylate 98.0+%, TCI America™
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CAS: 888504-28-7 Molecular Formula: C4H3KN2O3 Molecular Weight (g/mol): 166.177 MDL Number: MFCD08060085 InChI Key: BRHMYHXNUGVBCU-UHFFFAOYSA-M Synonym: 5-Methyl-1,3,4-oxadiazole-2-carboxylic Acid Potassium Salt PubChem CID: 24820502 IUPAC Name: potassium;5-methyl-1,3,4-oxadiazole-2-carboxylate SMILES: CC1=NN=C(O1)C(=O)[O-].[K+]
| PubChem CID | 24820502 |
|---|---|
| CAS | 888504-28-7 |
| Molecular Weight (g/mol) | 166.177 |
| MDL Number | MFCD08060085 |
| SMILES | CC1=NN=C(O1)C(=O)[O-].[K+] |
| Synonym | 5-Methyl-1,3,4-oxadiazole-2-carboxylic Acid Potassium Salt |
| IUPAC Name | potassium;5-methyl-1,3,4-oxadiazole-2-carboxylate |
| InChI Key | BRHMYHXNUGVBCU-UHFFFAOYSA-M |
| Molecular Formula | C4H3KN2O3 |
(Trifluoroacetyl)benzotriazole (mixture of 1H- and 2H- isomers) 98.0+%, TCI America™
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CAS: 183266-61-7 Molecular Formula: C8H4F3N3O Molecular Weight (g/mol): 215.135 MDL Number: MFCD00593044 InChI Key: GVQIQOIKWUOEJP-UHFFFAOYSA-N PubChem CID: 3358778 IUPAC Name: 1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone SMILES: C1=CC=C2C(=C1)N=NN2C(=O)C(F)(F)F
| PubChem CID | 3358778 |
|---|---|
| CAS | 183266-61-7 |
| Molecular Weight (g/mol) | 215.135 |
| MDL Number | MFCD00593044 |
| SMILES | C1=CC=C2C(=C1)N=NN2C(=O)C(F)(F)F |
| IUPAC Name | 1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone |
| InChI Key | GVQIQOIKWUOEJP-UHFFFAOYSA-N |
| Molecular Formula | C8H4F3N3O |
4-Phenylimidazole 98.0+%, TCI America™
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CAS: 670-95-1 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.177 MDL Number: MFCD00005197 InChI Key: XHLKOHSAWQPOFO-UHFFFAOYSA-N Synonym: 4-phenylimidazole,4-phenyl-1h-imidazole,1h-imidazole, 4-phenyl,4 5-phenylimidazole,imidazole, 4-phenyl,4-phenyl imidazole,chembl14145,pim,4-phenyl-1h-imidazol,5-phenylimidazole PubChem CID: 69590 IUPAC Name: 5-phenyl-1H-imidazole SMILES: C1=CC=C(C=C1)C2=CN=CN2
| PubChem CID | 69590 |
|---|---|
| CAS | 670-95-1 |
| Molecular Weight (g/mol) | 144.177 |
| MDL Number | MFCD00005197 |
| SMILES | C1=CC=C(C=C1)C2=CN=CN2 |
| Synonym | 4-phenylimidazole,4-phenyl-1h-imidazole,1h-imidazole, 4-phenyl,4 5-phenylimidazole,imidazole, 4-phenyl,4-phenyl imidazole,chembl14145,pim,4-phenyl-1h-imidazol,5-phenylimidazole |
| IUPAC Name | 5-phenyl-1H-imidazole |
| InChI Key | XHLKOHSAWQPOFO-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2 |
1-(4-Nitrobenzyl)-1,2,4-triazole 98.0+%, TCI America™
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Allopurinol 98.0+%, TCI America™
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4,7-Dibromo-2-(6-bromohexyl)benzotriazole 97.0+%, TCI America™
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CAS: 890704-02-6 Molecular Formula: C12H14Br3N3 Molecular Weight (g/mol): 439.977 MDL Number: MFCD19440927 InChI Key: VWPRIVLLHDPAJM-UHFFFAOYSA-N PubChem CID: 71721496 IUPAC Name: 4,7-dibromo-2-(6-bromohexyl)benzotriazole SMILES: C1=C(C2=NN(N=C2C(=C1)Br)CCCCCCBr)Br
| PubChem CID | 71721496 |
|---|---|
| CAS | 890704-02-6 |
| Molecular Weight (g/mol) | 439.977 |
| MDL Number | MFCD19440927 |
| SMILES | C1=C(C2=NN(N=C2C(=C1)Br)CCCCCCBr)Br |
| IUPAC Name | 4,7-dibromo-2-(6-bromohexyl)benzotriazole |
| InChI Key | VWPRIVLLHDPAJM-UHFFFAOYSA-N |
| Molecular Formula | C12H14Br3N3 |
2-(1-Naphthyl)-5-phenyloxazole 99.0+%, TCI America™
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CAS: 846-63-9 Molecular Formula: C19H13NO Molecular Weight (g/mol): 271.319 MDL Number: MFCD00019714 InChI Key: WWVFJJKBBZXWFV-UHFFFAOYSA-N Synonym: 2-1-naphthyl-5-phenyloxazole,alpha-npo,oxazole, 2-1-naphthalenyl-5-phenyl,2-1-naphthyl-5-phenyl-1,3-oxazole,2-naphthalen-1-yl-5-phenyloxazole,oxazole, 2-1-naphthyl-5-phenyl,.alpha.-npo,anpo,2-alpha-naphthyl-5-phenyloxazole,2-naphthalen-1-yl-5-phenyl-1,3-oxazole PubChem CID: 70058 IUPAC Name: 2-naphthalen-1-yl-5-phenyl-1,3-oxazole SMILES: C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC4=CC=CC=C43
| PubChem CID | 70058 |
|---|---|
| CAS | 846-63-9 |
| Molecular Weight (g/mol) | 271.319 |
| MDL Number | MFCD00019714 |
| SMILES | C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC4=CC=CC=C43 |
| Synonym | 2-1-naphthyl-5-phenyloxazole,alpha-npo,oxazole, 2-1-naphthalenyl-5-phenyl,2-1-naphthyl-5-phenyl-1,3-oxazole,2-naphthalen-1-yl-5-phenyloxazole,oxazole, 2-1-naphthyl-5-phenyl,.alpha.-npo,anpo,2-alpha-naphthyl-5-phenyloxazole,2-naphthalen-1-yl-5-phenyl-1,3-oxazole |
| IUPAC Name | 2-naphthalen-1-yl-5-phenyl-1,3-oxazole |
| InChI Key | WWVFJJKBBZXWFV-UHFFFAOYSA-N |
| Molecular Formula | C19H13NO |
2-Aminobenzotriazole 98.0+%, TCI America™
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CAS: 1614-11-5 Molecular Formula: C6H6N4 Molecular Weight (g/mol): 134.142 MDL Number: MFCD00724002 InChI Key: YYZVLEJDGSWXII-UHFFFAOYSA-N Synonym: 2-Benzotriazolamine PubChem CID: 295514 IUPAC Name: benzotriazol-2-amine SMILES: C1=CC2=NN(N=C2C=C1)N
| PubChem CID | 295514 |
|---|---|
| CAS | 1614-11-5 |
| Molecular Weight (g/mol) | 134.142 |
| MDL Number | MFCD00724002 |
| SMILES | C1=CC2=NN(N=C2C=C1)N |
| Synonym | 2-Benzotriazolamine |
| IUPAC Name | benzotriazol-2-amine |
| InChI Key | YYZVLEJDGSWXII-UHFFFAOYSA-N |
| Molecular Formula | C6H6N4 |
1,2-Dimethylbenzimidazole 98.0+%, TCI America™
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CAS: 2876-08-6 Molecular Formula: C9H10N2 Molecular Weight (g/mol): 146.19 MDL Number: MFCD00022840 InChI Key: PJQIBTFOXWGAEN-UHFFFAOYSA-N PubChem CID: 312693 IUPAC Name: 1,2-dimethylbenzimidazole SMILES: CC1=NC2=CC=CC=C2N1C
| PubChem CID | 312693 |
|---|---|
| CAS | 2876-08-6 |
| Molecular Weight (g/mol) | 146.19 |
| MDL Number | MFCD00022840 |
| SMILES | CC1=NC2=CC=CC=C2N1C |
| IUPAC Name | 1,2-dimethylbenzimidazole |
| InChI Key | PJQIBTFOXWGAEN-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2 |
2,4-Diphenyloxazole 99.0+%, TCI America™
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CAS: 838-41-5 Molecular Formula: C15H11NO Molecular Weight (g/mol): 221.259 MDL Number: MFCD00016890 InChI Key: VUPXKQHLZATXTR-UHFFFAOYSA-N PubChem CID: 168750 IUPAC Name: 2,4-diphenyl-1,3-oxazole SMILES: C1=CC=C(C=C1)C2=COC(=N2)C3=CC=CC=C3
| PubChem CID | 168750 |
|---|---|
| CAS | 838-41-5 |
| Molecular Weight (g/mol) | 221.259 |
| MDL Number | MFCD00016890 |
| SMILES | C1=CC=C(C=C1)C2=COC(=N2)C3=CC=CC=C3 |
| IUPAC Name | 2,4-diphenyl-1,3-oxazole |
| InChI Key | VUPXKQHLZATXTR-UHFFFAOYSA-N |
| Molecular Formula | C15H11NO |
2-Amino-4-methylthiazole Hydrochloride 98.0+%, TCI America™
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CAS: 6142-15-0 Molecular Formula: C4H7ClN2S Molecular Weight (g/mol): 150.62 MDL Number: MFCD00035214 InChI Key: WUMMJVLSXMYDRW-UHFFFAOYSA-N PubChem CID: 80240 IUPAC Name: hydrogen 4-methyl-1,3-thiazol-2-amine chloride SMILES: [H+].[Cl-].CC1=CSC(N)=N1
| PubChem CID | 80240 |
|---|---|
| CAS | 6142-15-0 |
| Molecular Weight (g/mol) | 150.62 |
| MDL Number | MFCD00035214 |
| SMILES | [H+].[Cl-].CC1=CSC(N)=N1 |
| IUPAC Name | hydrogen 4-methyl-1,3-thiazol-2-amine chloride |
| InChI Key | WUMMJVLSXMYDRW-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClN2S |
2-Methyl-5-nitroimidazole-1-ethanol 99.0+%, TCI America™
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CAS: 443-48-1 Molecular Formula: C6H9N3O3 Molecular Weight (g/mol): 171.156 MDL Number: MFCD00009750 InChI Key: VAOCPAMSLUNLGC-UHFFFAOYSA-N Synonym: 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-]
| PubChem CID | 4173 |
|---|---|
| CAS | 443-48-1 |
| Molecular Weight (g/mol) | 171.156 |
| ChEBI | CHEBI:6909 |
| MDL Number | MFCD00009750 |
| SMILES | CC1=NC=C(N1CCO)[N+](=O)[O-] |
| Synonym | metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol |
| IUPAC Name | 2-(2-methyl-5-nitroimidazol-1-yl)ethanol |
| InChI Key | VAOCPAMSLUNLGC-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3O3 |
Febuxostat 97.0+%, TCI America™
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CAS: 144060-53-7 Molecular Formula: C16H16N2O3S Molecular Weight (g/mol): 316.38 MDL Number: MFCD00871598 InChI Key: BQSJTQLCZDPROO-UHFFFAOYSA-N Synonym: febuxostat,adenuric,uloric,feburic,tmx 67,2-3-cyano-4-isobutoxyphenyl-4-methylthiazole-5-carboxylic acid,tmx-67,febuxostat usan,unii-101v0r1n2e,uloric tn PubChem CID: 134018 ChEBI: CHEBI:45943 IUPAC Name: 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid SMILES: CC(C)COC1=CC=C(C=C1C#N)C1=NC(C)=C(S1)C(O)=O
| PubChem CID | 134018 |
|---|---|
| CAS | 144060-53-7 |
| Molecular Weight (g/mol) | 316.38 |
| ChEBI | CHEBI:45943 |
| MDL Number | MFCD00871598 |
| SMILES | CC(C)COC1=CC=C(C=C1C#N)C1=NC(C)=C(S1)C(O)=O |
| Synonym | febuxostat,adenuric,uloric,feburic,tmx 67,2-3-cyano-4-isobutoxyphenyl-4-methylthiazole-5-carboxylic acid,tmx-67,febuxostat usan,unii-101v0r1n2e,uloric tn |
| IUPAC Name | 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid |
| InChI Key | BQSJTQLCZDPROO-UHFFFAOYSA-N |
| Molecular Formula | C16H16N2O3S |
2,4,5-Tribromoimidazole 98.0+%, TCI America™
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CAS: 2034-22-2 Molecular Formula: C3HBr3N2 Molecular Weight (g/mol): 304.767 InChI Key: JCGGPCDDFXIVQB-UHFFFAOYSA-N Synonym: 2,4,5-tribromoimidazole,1h-imidazole, 2,4,5-tribromo,imidazole, 2,4,5-tribromo,2,4,5-tribromoimidazo,tribromoimidazole,pubchem7150,2,5-tribromoimidazole,acmc-1cmbx,timtec-bb sbb001252,imidazole,4,5-tribromo PubChem CID: 16253 IUPAC Name: 2,4,5-tribromo-1H-imidazole SMILES: C1(=C(N=C(N1)Br)Br)Br
| PubChem CID | 16253 |
|---|---|
| CAS | 2034-22-2 |
| Molecular Weight (g/mol) | 304.767 |
| SMILES | C1(=C(N=C(N1)Br)Br)Br |
| Synonym | 2,4,5-tribromoimidazole,1h-imidazole, 2,4,5-tribromo,imidazole, 2,4,5-tribromo,2,4,5-tribromoimidazo,tribromoimidazole,pubchem7150,2,5-tribromoimidazole,acmc-1cmbx,timtec-bb sbb001252,imidazole,4,5-tribromo |
| IUPAC Name | 2,4,5-tribromo-1H-imidazole |
| InChI Key | JCGGPCDDFXIVQB-UHFFFAOYSA-N |
| Molecular Formula | C3HBr3N2 |
1,5-Dimethyl-3-(trifluoromethyl)pyrazole 98.0+%, TCI America™
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CAS: 79080-31-2 Molecular Formula: C6H7F3N2 Molecular Weight (g/mol): 164.131 MDL Number: MFCD04972844 InChI Key: LGTRXZPAYGKNLP-UHFFFAOYSA-N PubChem CID: 12747525 IUPAC Name: 1,5-dimethyl-3-(trifluoromethyl)pyrazole SMILES: CC1=CC(=NN1C)C(F)(F)F
| PubChem CID | 12747525 |
|---|---|
| CAS | 79080-31-2 |
| Molecular Weight (g/mol) | 164.131 |
| MDL Number | MFCD04972844 |
| SMILES | CC1=CC(=NN1C)C(F)(F)F |
| IUPAC Name | 1,5-dimethyl-3-(trifluoromethyl)pyrazole |
| InChI Key | LGTRXZPAYGKNLP-UHFFFAOYSA-N |
| Molecular Formula | C6H7F3N2 |