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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 (2,699)
Thiazoles (1,701)
Pyrazoles (1,357)
Triazoles (569)
Oxazoles (523)
Isoxazoles (233)
Oxadiazoles (203)
Thiadiazoles (68)
Dithiazoles (4)

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991 – 1,005 of 6,111 results
991

2-(1H-1,2,4-Triazol-3-yl)pyridine 98.0+%, TCI America™
SDP

CAS: 23195-62-2 Molecular Formula: C7H6N4 Molecular Weight (g/mol): 146.153 MDL Number: MFCD13188589 InChI Key: PVMLJDLTWMGZAH-UHFFFAOYSA-N Synonym: 3-(2-Pyridyl)-1,2,4-triazole PubChem CID: 10898842 IUPAC Name: 2-(1H-1,2,4-triazol-5-yl)pyridine SMILES: C1=CC=NC(=C1)C2=NC=NN2

PubChem CID 10898842
CAS 23195-62-2
Molecular Weight (g/mol) 146.153
MDL Number MFCD13188589
SMILES C1=CC=NC(=C1)C2=NC=NN2
Synonym 3-(2-Pyridyl)-1,2,4-triazole
IUPAC Name 2-(1H-1,2,4-triazol-5-yl)pyridine
InChI Key PVMLJDLTWMGZAH-UHFFFAOYSA-N
Molecular Formula C7H6N4
992

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

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
993

2-(1-Naphthyl)-5-phenyloxazole 99.0+%, TCI America™
SDP

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
994

1-Imidazoleacetic Acid 98.0+%, TCI America™
SDP

CAS: 22884-10-2 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.115 MDL Number: MFCD01721800 InChI Key: QAFBDRSXXHEXGB-UHFFFAOYSA-N Synonym: imidazol-1-yl-acetic acid,2-1h-imidazol-1-yl acetic acid,1h-imidazole-1-acetic acid,1h-imidazol-1-ylacetic acid,imidazole-1-acetic acid,1-imidazolyl acetic acid,1-imidazoleacetic acid,imidazol-1-ylacetic acid,imidazol-1-yl acetic acid,1-imidazolylacetic acid PubChem CID: 656129 ChEBI: CHEBI:70801 IUPAC Name: 2-imidazol-1-ylacetic acid SMILES: C1=CN(C=N1)CC(=O)O

PubChem CID 656129
CAS 22884-10-2
Molecular Weight (g/mol) 126.115
ChEBI CHEBI:70801
MDL Number MFCD01721800
SMILES C1=CN(C=N1)CC(=O)O
Synonym imidazol-1-yl-acetic acid,2-1h-imidazol-1-yl acetic acid,1h-imidazole-1-acetic acid,1h-imidazol-1-ylacetic acid,imidazole-1-acetic acid,1-imidazolyl acetic acid,1-imidazoleacetic acid,imidazol-1-ylacetic acid,imidazol-1-yl acetic acid,1-imidazolylacetic acid
IUPAC Name 2-imidazol-1-ylacetic acid
InChI Key QAFBDRSXXHEXGB-UHFFFAOYSA-N
Molecular Formula C5H6N2O2
995

Bismuthiol 98.0+%, TCI America™
SDP

CAS: 1072-71-5 Molecular Formula: C2H2N2S3 Molecular Weight (g/mol): 150.23 MDL Number: MFCD00003103 InChI Key: BIGYLAKFCGVRAN-UHFFFAOYSA-N Synonym: 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

PubChem CID 2723630
CAS 1072-71-5
Molecular Weight (g/mol) 150.23
MDL Number MFCD00003103
SMILES S=C1NNC(=S)S1
Synonym 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
IUPAC Name 1,3,4-thiadiazolidine-2,5-dithione
InChI Key BIGYLAKFCGVRAN-UHFFFAOYSA-N
Molecular Formula C2H2N2S3
996

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

CAS: 35935-34-3 Molecular Formula: C6H11IN2 Molecular Weight (g/mol): 238.07 MDL Number: MFCD03701101 InChI Key: IKQCDTXBZKMPBB-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium iodide,1-ethyl-3-methylimidazoliumiodide,1-ethyl-3-methyl-1h-imidazol-3-ium iodide,acmc-209ik2,dsstox_cid_29137,dsstox_rid_83356,dsstox_gsid_49281,ksc495i0n,1-ethyl-3-methyl imidazolium iodide salt PubChem CID: 11075478 IUPAC Name: 1-ethyl-3-methyl-1H-imidazol-3-ium iodide SMILES: [I-].CCN1C=C[N+](C)=C1

PubChem CID 11075478
CAS 35935-34-3
Molecular Weight (g/mol) 238.07
MDL Number MFCD03701101
SMILES [I-].CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium iodide,1-ethyl-3-methylimidazoliumiodide,1-ethyl-3-methyl-1h-imidazol-3-ium iodide,acmc-209ik2,dsstox_cid_29137,dsstox_rid_83356,dsstox_gsid_49281,ksc495i0n,1-ethyl-3-methyl imidazolium iodide salt
IUPAC Name 1-ethyl-3-methyl-1H-imidazol-3-ium iodide
InChI Key IKQCDTXBZKMPBB-UHFFFAOYSA-M
Molecular Formula C6H11IN2
997

N-Acetylimidazole 98.0+%, TCI America™
SDP

CAS: 2466-76-4 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD00005287 InChI Key: VIHYIVKEECZGOU-UHFFFAOYSA-N Synonym: 1-acetylimidazole,n-acetylimidazole,1-1h-imidazol-1-yl ethanone,1h-imidazole, 1-acetyl,acetylimidazole,1-acetyl-1h-imidazole,imidazole, 1-acetyl,3-acetylimidazole,unii-zmp8x1y11g,ccris 6534 PubChem CID: 17174 ChEBI: CHEBI:16984 IUPAC Name: 1-(1H-imidazol-1-yl)ethan-1-one SMILES: CC(=O)N1C=CN=C1

PubChem CID 17174
CAS 2466-76-4
Molecular Weight (g/mol) 110.12
ChEBI CHEBI:16984
MDL Number MFCD00005287
SMILES CC(=O)N1C=CN=C1
Synonym 1-acetylimidazole,n-acetylimidazole,1-1h-imidazol-1-yl ethanone,1h-imidazole, 1-acetyl,acetylimidazole,1-acetyl-1h-imidazole,imidazole, 1-acetyl,3-acetylimidazole,unii-zmp8x1y11g,ccris 6534
IUPAC Name 1-(1H-imidazol-1-yl)ethan-1-one
InChI Key VIHYIVKEECZGOU-UHFFFAOYSA-N
Molecular Formula C5H6N2O
998

DBD-CO-Hz 98.0+%, TCI America™
SDP

CAS: 179951-63-4 Molecular Formula: C11H16N6O4S Molecular Weight (g/mol): 328.35 MDL Number: MFCD01321128 InChI Key: CCERXXCKPHMFBQ-UHFFFAOYSA-N Synonym: 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)aminobenzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)amino-2,1,3-benzoxadiazole PubChem CID: 44630077 IUPAC Name: 7-{[(hydrazinecarbonyl)methyl](methyl)amino}-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide SMILES: CN(C)S(=O)(=O)C1=CC=C(N(C)CC(=O)NN)C2=NON=C12

PubChem CID 44630077
CAS 179951-63-4
Molecular Weight (g/mol) 328.35
MDL Number MFCD01321128
SMILES CN(C)S(=O)(=O)C1=CC=C(N(C)CC(=O)NN)C2=NON=C12
Synonym 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)aminobenzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)amino-2,1,3-benzoxadiazole
IUPAC Name 7-{[(hydrazinecarbonyl)methyl](methyl)amino}-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide
InChI Key CCERXXCKPHMFBQ-UHFFFAOYSA-N
Molecular Formula C11H16N6O4S
999

2-(4-Chlorophenyl)benzimidazole 98.0+%, TCI America™
SDP

CAS: 1019-85-8 Molecular Formula: C13H9ClN2 Molecular Weight (g/mol): 228.679 InChI Key: PTXUJRTVWRYYTE-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl benzimidazole,2-4-chlorophenyl-1h-benzoimidazole,2-4-chlorophenyl-1h-benzimidazole,2-4-chloro-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-chlorophenyl,2-4-chlorophenyl-1h-benzo d imidazole,2-4-chlorophenyl-1h-1,3-benzodiazole,acmc-2097xz,1h-benzimidazole,2-4-chlorophenyl PubChem CID: 759417 IUPAC Name: 2-(4-chlorophenyl)-1H-benzimidazole SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Cl

PubChem CID 759417
CAS 1019-85-8
Molecular Weight (g/mol) 228.679
SMILES C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Cl
Synonym 2-4-chlorophenyl benzimidazole,2-4-chlorophenyl-1h-benzoimidazole,2-4-chlorophenyl-1h-benzimidazole,2-4-chloro-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-chlorophenyl,2-4-chlorophenyl-1h-benzo d imidazole,2-4-chlorophenyl-1h-1,3-benzodiazole,acmc-2097xz,1h-benzimidazole,2-4-chlorophenyl
IUPAC Name 2-(4-chlorophenyl)-1H-benzimidazole
InChI Key PTXUJRTVWRYYTE-UHFFFAOYSA-N
Molecular Formula C13H9ClN2
1,000

2-Ethyl-4,5-dimethylthiazole 98.0+%, TCI America™
SDP

CAS: 873-64-3 Molecular Formula: C7H11NS Molecular Weight (g/mol): 141.232 MDL Number: MFCD00053125 InChI Key: BVOKJOZBJOWZNJ-UHFFFAOYSA-N PubChem CID: 522877 IUPAC Name: 2-ethyl-4,5-dimethyl-1,3-thiazole SMILES: CCC1=NC(=C(S1)C)C

PubChem CID 522877
CAS 873-64-3
Molecular Weight (g/mol) 141.232
MDL Number MFCD00053125
SMILES CCC1=NC(=C(S1)C)C
IUPAC Name 2-ethyl-4,5-dimethyl-1,3-thiazole
InChI Key BVOKJOZBJOWZNJ-UHFFFAOYSA-N
Molecular Formula C7H11NS
1,001

1-Butyl-2,3-dimethylimidazolium Hexafluorophosphate 97.0+%, TCI America™
SDP

CAS: 227617-70-1 Molecular Formula: C9H17F6N2P Molecular Weight (g/mol): 298.21 MDL Number: MFCD03790877 InChI Key: JWFPQAXAGSAKRF-UHFFFAOYSA-N Synonym: 1-butyl-2,3-dimethylimidazolium hexafluorophosphate,1-butyl-2,3-dimethyl-1h-imidazol-3-ium hexafluorophosphate v,1-butyl-2,3-dimethylimidazol-1-ium hexafluorophosphate,3-butyl-1,2-dimethylimidazol-1-ium hexafluorophosphate,acmc-209fyn,bdmim pf6,c4c1mim pf6,c4mmim pf6,dsstox_cid_27883,dsstox_rid_82636 PubChem CID: 11243457 IUPAC Name: 1-butyl-2,3-dimethyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide SMILES: F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1C

PubChem CID 11243457
CAS 227617-70-1
Molecular Weight (g/mol) 298.21
MDL Number MFCD03790877
SMILES F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1C
Synonym 1-butyl-2,3-dimethylimidazolium hexafluorophosphate,1-butyl-2,3-dimethyl-1h-imidazol-3-ium hexafluorophosphate v,1-butyl-2,3-dimethylimidazol-1-ium hexafluorophosphate,3-butyl-1,2-dimethylimidazol-1-ium hexafluorophosphate,acmc-209fyn,bdmim pf6,c4c1mim pf6,c4mmim pf6,dsstox_cid_27883,dsstox_rid_82636
IUPAC Name 1-butyl-2,3-dimethyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide
InChI Key JWFPQAXAGSAKRF-UHFFFAOYSA-N
Molecular Formula C9H17F6N2P
1,002

1-Butyl-3-methylimidazolium Dicyanamide 96.0+%, TCI America™
SDP

CAS: 448245-52-1 Molecular Formula: C10H15N5 Molecular Weight (g/mol): 205.265 MDL Number: MFCD07784457 InChI Key: ICIVTHOGIQHZRY-UHFFFAOYSA-N Synonym: 1-butyl-3-methylimidazolium dicyanamide,1-butyl-3-methylimidazolium dicyamide,1-butyl-3-methylimidazolium; dicyanoazanide,bmim dca,dsstox_cid_27886,dsstox_rid_82639,dsstox_gsid_47910,c4mim; dicyanoazanide,1-butyl-3-methyl-1h-imidazol-3-ium cyanoimino methylidene azanide,1-butyl-3-methylimidazolium; cyanoimino methylidene azanide PubChem CID: 11171745 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;cyanoiminomethylideneazanide SMILES: CCCCN1C=C[N+](=C1)C.C(=[N-])=NC#N

PubChem CID 11171745
CAS 448245-52-1
Molecular Weight (g/mol) 205.265
MDL Number MFCD07784457
SMILES CCCCN1C=C[N+](=C1)C.C(=[N-])=NC#N
Synonym 1-butyl-3-methylimidazolium dicyanamide,1-butyl-3-methylimidazolium dicyamide,1-butyl-3-methylimidazolium; dicyanoazanide,bmim dca,dsstox_cid_27886,dsstox_rid_82639,dsstox_gsid_47910,c4mim; dicyanoazanide,1-butyl-3-methyl-1h-imidazol-3-ium cyanoimino methylidene azanide,1-butyl-3-methylimidazolium; cyanoimino methylidene azanide
IUPAC Name 1-butyl-3-methylimidazol-3-ium;cyanoiminomethylideneazanide
InChI Key ICIVTHOGIQHZRY-UHFFFAOYSA-N
Molecular Formula C10H15N5
1,003

Famotidine 98.0+%, TCI America™
SDP

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
1,004

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

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
1,005

3-Amino-4-pyrazolecarbonitrile 98.0+%, TCI America™
SDP

CAS: 16617-46-2 Molecular Formula: C4H4N4 Molecular Weight (g/mol): 108.104 MDL Number: MFCD00005237 InChI Key: FFNKBQRKZRMYCL-UHFFFAOYSA-N Synonym: 3-amino-4-pyrazolecarbonitrile,3-amino-1h-pyrazole-4-carbonitrile,3-amino-4-cyanopyrazole,3-aminopyrazole-4-carbonitrile,5-amino-4-cyanopyrazole,1h-pyrazole-4-carbonitrile, 3-amino,5-aminopyrazole-4-carbonitrile,3-amino-4-cyano-1h-pyrazole,4-cyano-5-aminopyrazole,3-amino-4-cyano pyrazole PubChem CID: 85515 IUPAC Name: 5-amino-1H-pyrazole-4-carbonitrile SMILES: C1=NNC(=C1C#N)N

PubChem CID 85515
CAS 16617-46-2
Molecular Weight (g/mol) 108.104
MDL Number MFCD00005237
SMILES C1=NNC(=C1C#N)N
Synonym 3-amino-4-pyrazolecarbonitrile,3-amino-1h-pyrazole-4-carbonitrile,3-amino-4-cyanopyrazole,3-aminopyrazole-4-carbonitrile,5-amino-4-cyanopyrazole,1h-pyrazole-4-carbonitrile, 3-amino,5-aminopyrazole-4-carbonitrile,3-amino-4-cyano-1h-pyrazole,4-cyano-5-aminopyrazole,3-amino-4-cyano pyrazole
IUPAC Name 5-amino-1H-pyrazole-4-carbonitrile
InChI Key FFNKBQRKZRMYCL-UHFFFAOYSA-N
Molecular Formula C4H4N4