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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.
Thiazoles (7,176)
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811 – 825 of 16,829 results
811

Febuxostat 97.0+%, TCI America™

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
812

1,3-Dimethylimidazolium Bis(trifluoromethanesulfonyl)imide 98.0+%, TCI America™

CAS: 174899-81-1 Molecular Formula: C7H9F6N3O4S2 Molecular Weight (g/mol): 377.276 MDL Number: MFCD18251322 InChI Key: SAYMDKMGIAANGQ-UHFFFAOYSA-N PubChem CID: 11349411 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1,3-dimethylimidazol-1-ium SMILES: CN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

PubChem CID 11349411
CAS 174899-81-1
Molecular Weight (g/mol) 377.276
MDL Number MFCD18251322
SMILES CN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
IUPAC Name bis(trifluoromethylsulfonyl)azanide;1,3-dimethylimidazol-1-ium
InChI Key SAYMDKMGIAANGQ-UHFFFAOYSA-N
Molecular Formula C7H9F6N3O4S2
813

(1-Imidazolyl)acetonitrile 98.0+%, TCI America™

CAS: 98873-55-3 Molecular Formula: C5H5N3 Molecular Weight (g/mol): 107.116 MDL Number: MFCD06421433 InChI Key: ZPGCVVBPGQJSPX-UHFFFAOYSA-N Synonym: 2-1h-imidazol-1-yl acetonitrile,imidazol-1-yl-acetonitrile,1-cyanomethyl imidazole,1h-imidazole-1-acetonitrile,1h-imidazol-1-ylacetonitrile,2-1-imidazolyl acetonitrile,1-imidazolyl acetonitrile,2-imidazol-1-yl acetonitrile,1h-imidazol-1-yl acetonitrile,1-cyanomethylimidazole PubChem CID: 11804695 IUPAC Name: 2-imidazol-1-ylacetonitrile SMILES: C1=CN(C=N1)CC#N

PubChem CID 11804695
CAS 98873-55-3
Molecular Weight (g/mol) 107.116
MDL Number MFCD06421433
SMILES C1=CN(C=N1)CC#N
Synonym 2-1h-imidazol-1-yl acetonitrile,imidazol-1-yl-acetonitrile,1-cyanomethyl imidazole,1h-imidazole-1-acetonitrile,1h-imidazol-1-ylacetonitrile,2-1-imidazolyl acetonitrile,1-imidazolyl acetonitrile,2-imidazol-1-yl acetonitrile,1h-imidazol-1-yl acetonitrile,1-cyanomethylimidazole
IUPAC Name 2-imidazol-1-ylacetonitrile
InChI Key ZPGCVVBPGQJSPX-UHFFFAOYSA-N
Molecular Formula C5H5N3
814

Famciclovir 98.0+%, TCI America™

CAS: 104227-87-4 Molecular Formula: C14H19N5O4 Molecular Weight (g/mol): 321.337 MDL Number: MFCD00866964 InChI Key: GGXKWVWZWMLJEH-UHFFFAOYSA-N Synonym: 2-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3-propanediol Diacetate PubChem CID: 3324 ChEBI: CHEBI:4974 IUPAC Name: [2-(acetyloxymethyl)-4-(2-aminopurin-9-yl)butyl] acetate SMILES: CC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)COC(=O)C

PubChem CID 3324
CAS 104227-87-4
Molecular Weight (g/mol) 321.337
ChEBI CHEBI:4974
MDL Number MFCD00866964
SMILES CC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)COC(=O)C
Synonym 2-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3-propanediol Diacetate
IUPAC Name [2-(acetyloxymethyl)-4-(2-aminopurin-9-yl)butyl] acetate
InChI Key GGXKWVWZWMLJEH-UHFFFAOYSA-N
Molecular Formula C14H19N5O4
815

1-Methyl-3-propylimidazolium Tetrafluoroborate 98.0+%, TCI America™

CAS: 244193-48-4 Molecular Formula: C7H13BF4N2 Molecular Weight (g/mol): 211.999 MDL Number: MFCD14156016 InChI Key: XFTQQJUVYZPNRC-UHFFFAOYSA-N PubChem CID: 11171853 IUPAC Name: 1-methyl-3-propylimidazol-1-ium;tetrafluoroborate SMILES: [B-](F)(F)(F)F.CCCN1C=C[N+](=C1)C

PubChem CID 11171853
CAS 244193-48-4
Molecular Weight (g/mol) 211.999
MDL Number MFCD14156016
SMILES [B-](F)(F)(F)F.CCCN1C=C[N+](=C1)C
IUPAC Name 1-methyl-3-propylimidazol-1-ium;tetrafluoroborate
InChI Key XFTQQJUVYZPNRC-UHFFFAOYSA-N
Molecular Formula C7H13BF4N2
816

1-Ethyl-3-methylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 145022-44-2 Molecular Formula: C7H11F3N2O3S Molecular Weight (g/mol): 260.231 MDL Number: MFCD00210008 InChI Key: ZPTRYWVRCNOTAS-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium trifluoromethanesulfonate,1-ethyl-3-methylimidazolium triflate,1-ethyl-3-methyl-1h-imidazol-3-ium trifluoromethanesulfonate,acmc-209ctv,dsstox_cid_27941,dsstox_rid_82693,dsstox_gsid_47965,1-ethyl-3-methylimidazoliumtrifluoromethanesulfonate,ksc685i3d,1-ethyl-3-methylimidazolium trifluoromethanesulfon PubChem CID: 2758874 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;trifluoromethanesulfonate SMILES: CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]

PubChem CID 2758874
CAS 145022-44-2
Molecular Weight (g/mol) 260.231
MDL Number MFCD00210008
SMILES CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]
Synonym 1-ethyl-3-methylimidazolium trifluoromethanesulfonate,1-ethyl-3-methylimidazolium triflate,1-ethyl-3-methyl-1h-imidazol-3-ium trifluoromethanesulfonate,acmc-209ctv,dsstox_cid_27941,dsstox_rid_82693,dsstox_gsid_47965,1-ethyl-3-methylimidazoliumtrifluoromethanesulfonate,ksc685i3d,1-ethyl-3-methylimidazolium trifluoromethanesulfon
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;trifluoromethanesulfonate
InChI Key ZPTRYWVRCNOTAS-UHFFFAOYSA-M
Molecular Formula C7H11F3N2O3S
817

1-Ethyl-3-methylimidazolium Tetrafluoroborate 97.0+%, TCI America™

CAS: 143314-16-3 Molecular Formula: C6H11BF4N2 Molecular Weight (g/mol): 197.97 MDL Number: MFCD00216668 InChI Key: CUNYTRQQXKCRTJ-UHFFFAOYSA-N Synonym: 1-ethyl-3-methylimidazolium tetrafluoroborate,1-ethyl-3-methyl-1h-imidazol-3-ium tetrafluoroborate,emimbf4,basionics™ ee 03,acmc-209cq9,dsstox_cid_29074,dsstox_rid_83293,dsstox_gsid_49218,ksc174g8n,1-methyl-3-ethylimidazolium tetrafluoroborate PubChem CID: 2769348 IUPAC Name: 1-ethyl-3-methyl-1H-imidazol-3-ium; tetrafluoroboranuide SMILES: F[B-](F)(F)F.CCN1C=C[N+](C)=C1

PubChem CID 2769348
CAS 143314-16-3
Molecular Weight (g/mol) 197.97
MDL Number MFCD00216668
SMILES F[B-](F)(F)F.CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium tetrafluoroborate,1-ethyl-3-methyl-1h-imidazol-3-ium tetrafluoroborate,emimbf4,basionics™ ee 03,acmc-209cq9,dsstox_cid_29074,dsstox_rid_83293,dsstox_gsid_49218,ksc174g8n,1-methyl-3-ethylimidazolium tetrafluoroborate
IUPAC Name 1-ethyl-3-methyl-1H-imidazol-3-ium; tetrafluoroboranuide
InChI Key CUNYTRQQXKCRTJ-UHFFFAOYSA-N
Molecular Formula C6H11BF4N2
818

1-Ethyl-3-methylimidazolium Hexafluorophosphate 98.0+%, TCI America™

CAS: 155371-19-0 Molecular Formula: C6H11F6N2P Molecular Weight (g/mol): 256.132 MDL Number: MFCD00216703 InChI Key: DPDAKOVGQUGTHH-UHFFFAOYSA-N Synonym: 1-ethyl-3-methylimidazolium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate v,emimpf6,dsstox_cid_27897,dsstox_rid_82650,dsstox_gsid_47921,ksc174g8p,1-ethyl-3-methylimidazol-3-ium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate,1-ethyl-3-methylimidazolium hexafluorophosphate hplc PubChem CID: 2758873 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;hexafluorophosphate SMILES: CCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F

PubChem CID 2758873
CAS 155371-19-0
Molecular Weight (g/mol) 256.132
MDL Number MFCD00216703
SMILES CCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F
Synonym 1-ethyl-3-methylimidazolium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate v,emimpf6,dsstox_cid_27897,dsstox_rid_82650,dsstox_gsid_47921,ksc174g8p,1-ethyl-3-methylimidazol-3-ium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate,1-ethyl-3-methylimidazolium hexafluorophosphate hplc
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;hexafluorophosphate
InChI Key DPDAKOVGQUGTHH-UHFFFAOYSA-N
Molecular Formula C6H11F6N2P
819

Famotidine 98.0+%, TCI America™

CAS: 76824-35-6 Molecular Formula: C8H15N7O2S3 Molecular Weight (g/mol): 337.435 InChI Key: XUFQPHANEAPEMJ-UHFFFAOYSA-N Synonym: famotidine,pepcid ac,apogastine,amfamox,antodine,bestidine,digervin,dispromil,famodil,gastridin PubChem CID: 5702160 ChEBI: CHEBI:4975 IUPAC Name: 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoylpropanimidamide SMILES: C1=C(N=C(S1)N=C(N)N)CSCCC(=NS(=O)(=O)N)N

PubChem CID 5702160
CAS 76824-35-6
Molecular Weight (g/mol) 337.435
ChEBI CHEBI:4975
SMILES C1=C(N=C(S1)N=C(N)N)CSCCC(=NS(=O)(=O)N)N
Synonym famotidine,pepcid ac,apogastine,amfamox,antodine,bestidine,digervin,dispromil,famodil,gastridin
IUPAC Name 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoylpropanimidamide
InChI Key XUFQPHANEAPEMJ-UHFFFAOYSA-N
Molecular Formula C8H15N7O2S3
820

3-Phenylisoxazole-5-carboxylic Acid 98.0+%, TCI America™

CAS: 14442-12-7 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD01936010 InChI Key: YGTFDJRCCBKLDM-UHFFFAOYSA-N Synonym: 3-phenylisoxazole-5-carboxylic acid,3-phenyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-phenyl,3-phenyl-isoxazole-5-carboxylic acid,phenylisoxazolecarboxylicacid,5-carboxy-3-phenylisoxazole,3-phenylisoxazole-5-carboxylic,3-phenyl-5-isoxazolecarboxylicacid,3-phenylisoxazole-5-carboxylicacid,3-phenyl-5-isoxazole carboxylic acid PubChem CID: 737474 IUPAC Name: 3-phenyl-1,2-oxazole-5-carboxylic acid SMILES: C1=CC=C(C=C1)C2=NOC(=C2)C(=O)O

PubChem CID 737474
CAS 14442-12-7
Molecular Weight (g/mol) 189.17
MDL Number MFCD01936010
SMILES C1=CC=C(C=C1)C2=NOC(=C2)C(=O)O
Synonym 3-phenylisoxazole-5-carboxylic acid,3-phenyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-phenyl,3-phenyl-isoxazole-5-carboxylic acid,phenylisoxazolecarboxylicacid,5-carboxy-3-phenylisoxazole,3-phenylisoxazole-5-carboxylic,3-phenyl-5-isoxazolecarboxylicacid,3-phenylisoxazole-5-carboxylicacid,3-phenyl-5-isoxazole carboxylic acid
IUPAC Name 3-phenyl-1,2-oxazole-5-carboxylic acid
InChI Key YGTFDJRCCBKLDM-UHFFFAOYSA-N
Molecular Formula C10H7NO3
821

Methyl 3-Hydroxyisoxazole-5-carboxylate 98.0+%, TCI America™

CAS: 10068-07-2 Molecular Formula: C5H5NO4 Molecular Weight (g/mol): 143.10 MDL Number: MFCD00062870 InChI Key: BBFWUUBQSXVHHZ-UHFFFAOYSA-N Synonym: methyl 3-hydroxyisoxazole-5-carboxylate,methyl 3-hydroxy-5-isoxazolecarboxylate,methyl 3-hydroxy-1,2-oxazole-5-carboxylate,3-hydroxyisoxazole-5-carboxylic acid methyl ester,methyl 3-hydroxyl-5-isoxazolecarboxylate,methyl-3-hydroxy-5-isoxazolecarboxylate,5-isoxazolecarboxylic acid, 2,3-dihydro-3-oxo-, methyl ester,3-hydroxy-isoxazole-5-carboxylic acid methyl ester,methyl 3-oxo-2,3-dihydro-1,2-oxazole-5-carboxylate,methyl 3-oxo-2h-1,2-oxazole-5-carboxylate PubChem CID: 2724585 IUPAC Name: methyl 3-oxo-2,3-dihydro-1,2-oxazole-5-carboxylate SMILES: COC(=O)C1=CC(=O)NO1

PubChem CID 2724585
CAS 10068-07-2
Molecular Weight (g/mol) 143.10
MDL Number MFCD00062870
SMILES COC(=O)C1=CC(=O)NO1
Synonym methyl 3-hydroxyisoxazole-5-carboxylate,methyl 3-hydroxy-5-isoxazolecarboxylate,methyl 3-hydroxy-1,2-oxazole-5-carboxylate,3-hydroxyisoxazole-5-carboxylic acid methyl ester,methyl 3-hydroxyl-5-isoxazolecarboxylate,methyl-3-hydroxy-5-isoxazolecarboxylate,5-isoxazolecarboxylic acid, 2,3-dihydro-3-oxo-, methyl ester,3-hydroxy-isoxazole-5-carboxylic acid methyl ester,methyl 3-oxo-2,3-dihydro-1,2-oxazole-5-carboxylate,methyl 3-oxo-2h-1,2-oxazole-5-carboxylate
IUPAC Name methyl 3-oxo-2,3-dihydro-1,2-oxazole-5-carboxylate
InChI Key BBFWUUBQSXVHHZ-UHFFFAOYSA-N
Molecular Formula C5H5NO4
822

Methyl 1H-Imidazole-5-carboxylate 97.0+%, TCI America™

CAS: 17325-26-7 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00216584 InChI Key: DVLGIQNHKLWSRU-UHFFFAOYSA-N Synonym: methyl 4-imidazolecarboxylate,methyl 1h-imidazole-4-carboxylate,methyl imidazole-4-carboxylate,1h-imidazole-4-carboxylic acid, methyl ester,1h-imidazole-5-carboxylic acid methyl ester,methyl-4-imidazolecarboxylate,1h-imidazole-4-carboxylic acid methyl ester,methyl 3h-imidazole-4-carboxylate,imidazole-4-carboxylic acid, methyl ester,zlchem 863 PubChem CID: 565661 IUPAC Name: methyl 1H-imidazole-5-carboxylate SMILES: COC(=O)C1=CN=CN1

PubChem CID 565661
CAS 17325-26-7
Molecular Weight (g/mol) 126.12
MDL Number MFCD00216584
SMILES COC(=O)C1=CN=CN1
Synonym methyl 4-imidazolecarboxylate,methyl 1h-imidazole-4-carboxylate,methyl imidazole-4-carboxylate,1h-imidazole-4-carboxylic acid, methyl ester,1h-imidazole-5-carboxylic acid methyl ester,methyl-4-imidazolecarboxylate,1h-imidazole-4-carboxylic acid methyl ester,methyl 3h-imidazole-4-carboxylate,imidazole-4-carboxylic acid, methyl ester,zlchem 863
IUPAC Name methyl 1H-imidazole-5-carboxylate
InChI Key DVLGIQNHKLWSRU-UHFFFAOYSA-N
Molecular Formula C5H6N2O2
823

1-Methyl-3-pentylimidazolium Bromide 98.0+%, TCI America™

CAS: 343851-31-0 Molecular Formula: C9H17BrN2 Molecular Weight (g/mol): 233.153 MDL Number: MFCD19382537 InChI Key: PXFKRXXEFJDOMO-UHFFFAOYSA-M Synonym: 1-Methyl-3-pentyl-1H-imidazol-3-ium Bromide PubChem CID: 10537569 IUPAC Name: 1-methyl-3-pentylimidazol-1-ium;bromide SMILES: CCCCCN1C=C[N+](=C1)C.[Br-]

PubChem CID 10537569
CAS 343851-31-0
Molecular Weight (g/mol) 233.153
MDL Number MFCD19382537
SMILES CCCCCN1C=C[N+](=C1)C.[Br-]
Synonym 1-Methyl-3-pentyl-1H-imidazol-3-ium Bromide
IUPAC Name 1-methyl-3-pentylimidazol-1-ium;bromide
InChI Key PXFKRXXEFJDOMO-UHFFFAOYSA-M
Molecular Formula C9H17BrN2
824

1-(Trifluoromethanesulfonyl)-1H-benzotriazole 98.0+%, TCI America™

CAS: 117632-84-5 Molecular Formula: C7H4F3N3O2S Molecular Weight (g/mol): 251.18 MDL Number: MFCD00963686 InChI Key: QTTZLMGXPHZYKR-UHFFFAOYSA-N PubChem CID: 3692410 IUPAC Name: 1-trifluoromethanesulfonyl-1H-1,2,3-benzotriazole SMILES: FC(F)(F)S(=O)(=O)N1N=NC2=CC=CC=C12

PubChem CID 3692410
CAS 117632-84-5
Molecular Weight (g/mol) 251.18
MDL Number MFCD00963686
SMILES FC(F)(F)S(=O)(=O)N1N=NC2=CC=CC=C12
IUPAC Name 1-trifluoromethanesulfonyl-1H-1,2,3-benzotriazole
InChI Key QTTZLMGXPHZYKR-UHFFFAOYSA-N
Molecular Formula C7H4F3N3O2S
825

Methyl 2-Bromothiazole-4-carboxylate 98.0+%, TCI America™

CAS: 170235-26-4 Molecular Formula: C5H4BrNO2S Molecular Weight (g/mol): 222.056 MDL Number: MFCD06659908 InChI Key: YOWKNNKTQWCYNC-UHFFFAOYSA-N PubChem CID: 2763213 IUPAC Name: methyl 2-bromo-1,3-thiazole-4-carboxylate SMILES: COC(=O)C1=CSC(=N1)Br

PubChem CID 2763213
CAS 170235-26-4
Molecular Weight (g/mol) 222.056
MDL Number MFCD06659908
SMILES COC(=O)C1=CSC(=N1)Br
IUPAC Name methyl 2-bromo-1,3-thiazole-4-carboxylate
InChI Key YOWKNNKTQWCYNC-UHFFFAOYSA-N
Molecular Formula C5H4BrNO2S