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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 (2,694)
Thiazoles (1,765)
Pyrazoles (1,323)
Triazoles (567)
Oxazoles (497)
Isoxazoles (229)
Oxadiazoles (228)
Thiadiazoles (68)
Dithiazoles (4)

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556 – 570 of 6,127 results
556

Ethyl 4-methyloxazole-5-carboxylate, 97+%

CAS: 20485-39-6 Molecular Formula: C7H9NO3 Molecular Weight (g/mol): 155.15 MDL Number: MFCD00062573 InChI Key: XNMORZSEENWFLI-UHFFFAOYSA-N PubChem CID: 88558 IUPAC Name: ethyl 4-methyl-1,3-oxazole-5-carboxylate SMILES: CCOC(=O)C1=C(C)N=CO1

PubChem CID 88558
CAS 20485-39-6
Molecular Weight (g/mol) 155.15
MDL Number MFCD00062573
SMILES CCOC(=O)C1=C(C)N=CO1
IUPAC Name ethyl 4-methyl-1,3-oxazole-5-carboxylate
InChI Key XNMORZSEENWFLI-UHFFFAOYSA-N
Molecular Formula C7H9NO3
557

2,4,5-Trimethyloxazole, 97%

CAS: 20662-84-4 Molecular Formula: C6H9NO Molecular Weight (g/mol): 111.144 MDL Number: MFCD00005308 InChI Key: ZRLDBDZSLLGDOX-UHFFFAOYSA-N Synonym: 2,4,5-trimethyloxazole,trimethyloxazole,oxazole, trimethyl,unii-b04pf51wxi,2,4,5-trimethyl oxazole,trimethyl-1,3-oxazole,b04pf51wxi,oxazole, 2,4,5-trimethyl,trimethyl-oxazole,pubchem8636 PubChem CID: 30215 IUPAC Name: 2,4,5-trimethyl-1,3-oxazole SMILES: CC1=C(OC(=N1)C)C

PubChem CID 30215
CAS 20662-84-4
Molecular Weight (g/mol) 111.144
MDL Number MFCD00005308
SMILES CC1=C(OC(=N1)C)C
Synonym 2,4,5-trimethyloxazole,trimethyloxazole,oxazole, trimethyl,unii-b04pf51wxi,2,4,5-trimethyl oxazole,trimethyl-1,3-oxazole,b04pf51wxi,oxazole, 2,4,5-trimethyl,trimethyl-oxazole,pubchem8636
IUPAC Name 2,4,5-trimethyl-1,3-oxazole
InChI Key ZRLDBDZSLLGDOX-UHFFFAOYSA-N
Molecular Formula C6H9NO
558

1-Butyl-2,3-dimethylimidazolium hexafluorophosphate, 99%

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-dimethylimidazol-3-ium;hexafluorophosphate 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-dimethylimidazol-3-ium;hexafluorophosphate
InChI Key JWFPQAXAGSAKRF-UHFFFAOYSA-N
Molecular Formula C9H17F6N2P
559

2-Amino-4-(3-pyridyl)thiazole, 97%, Thermo Scientific™

CAS: 30235-27-9 Molecular Formula: C8H7N3S Molecular Weight (g/mol): 177.225 MDL Number: MFCD00218013 InChI Key: XOHZQGAYUHOJPR-UHFFFAOYSA-N Synonym: 4-pyridin-3-yl thiazol-2-amine,2-amino-4-3-pyridyl thiazole,4-pyridin-3-yl-thiazol-2-ylamine,4-pyridin-3-yl-1,3-thiazol-2-amine,4-3-pyridinyl-2-thiazolamine,2-thiazolamine, 4-3-pyridinyl,ccris 6699,2-amino-4-pyridin-3-yl-1,3-thiazole,4-pyridine-3-yl-thiazol-2-ylamine,4-3-pyridinyl-1,3-thiazol-2-ylamine PubChem CID: 154893 IUPAC Name: 4-pyridin-3-yl-1,3-thiazol-2-amine SMILES: C1=CC(=CN=C1)C2=CSC(=N2)N

PubChem CID 154893
CAS 30235-27-9
Molecular Weight (g/mol) 177.225
MDL Number MFCD00218013
SMILES C1=CC(=CN=C1)C2=CSC(=N2)N
Synonym 4-pyridin-3-yl thiazol-2-amine,2-amino-4-3-pyridyl thiazole,4-pyridin-3-yl-thiazol-2-ylamine,4-pyridin-3-yl-1,3-thiazol-2-amine,4-3-pyridinyl-2-thiazolamine,2-thiazolamine, 4-3-pyridinyl,ccris 6699,2-amino-4-pyridin-3-yl-1,3-thiazole,4-pyridine-3-yl-thiazol-2-ylamine,4-3-pyridinyl-1,3-thiazol-2-ylamine
IUPAC Name 4-pyridin-3-yl-1,3-thiazol-2-amine
InChI Key XOHZQGAYUHOJPR-UHFFFAOYSA-N
Molecular Formula C8H7N3S
560

1,1'-Thiocarbonyldiimidazole, tech 90%

CAS: 6160-65-2 Molecular Formula: C7H6N4S Molecular Weight (g/mol): 178.21 MDL Number: MFCD00005289 InChI Key: RAFNCPHFRHZCPS-UHFFFAOYSA-N Synonym: 1,1'-thiocarbonyldiimidazole,thiocarbonyldiimidazole,n,n'-thiocarbonyldiimidazole,di 1h-imidazol-1-yl methanethione,1,1-thiocarbonyldiimidazole,di imidazol-1-yl methanethione,n,n'-thiocarbonyldiimidazole tcdi,1h-imidazole, 1,1'-carbonothioylbis,n,n-thiocarbonyldiimidazole,1,1'-carbonothioylbis-1h-imidazole PubChem CID: 80264 IUPAC Name: di(imidazol-1-yl)methanethione SMILES: S=C(N1C=CN=C1)N1C=CN=C1

PubChem CID 80264
CAS 6160-65-2
Molecular Weight (g/mol) 178.21
MDL Number MFCD00005289
SMILES S=C(N1C=CN=C1)N1C=CN=C1
Synonym 1,1'-thiocarbonyldiimidazole,thiocarbonyldiimidazole,n,n'-thiocarbonyldiimidazole,di 1h-imidazol-1-yl methanethione,1,1-thiocarbonyldiimidazole,di imidazol-1-yl methanethione,n,n'-thiocarbonyldiimidazole tcdi,1h-imidazole, 1,1'-carbonothioylbis,n,n-thiocarbonyldiimidazole,1,1'-carbonothioylbis-1h-imidazole
IUPAC Name di(imidazol-1-yl)methanethione
InChI Key RAFNCPHFRHZCPS-UHFFFAOYSA-N
Molecular Formula C7H6N4S
561

Tetrakis(1-pyrazolyl)borate, potassium salt, 95%

CAS: 14782-58-2 Molecular Formula: C12H12BKN8 Molecular Weight (g/mol): 318.2 MDL Number: MFCD00800557 InChI Key: RKBGLZQVHBLUBM-UHFFFAOYSA-N Synonym: tetrakis 1-pyrazolyl borate,potassium tetrakis pyrazol-1-yloxy boranuide PubChem CID: 92043288 IUPAC Name: potassium;tetra(pyrazol-1-yloxy)boranuide SMILES: [B-](ON1C=CC=N1)(ON2C=CC=N2)(ON3C=CC=N3)ON4C=CC=N4.[K+]

PubChem CID 92043288
CAS 14782-58-2
Molecular Weight (g/mol) 318.2
MDL Number MFCD00800557
SMILES [B-](ON1C=CC=N1)(ON2C=CC=N2)(ON3C=CC=N3)ON4C=CC=N4.[K+]
Synonym tetrakis 1-pyrazolyl borate,potassium tetrakis pyrazol-1-yloxy boranuide
IUPAC Name potassium;tetra(pyrazol-1-yloxy)boranuide
InChI Key RKBGLZQVHBLUBM-UHFFFAOYSA-N
Molecular Formula C12H12BKN8
562

1-n-Butyl-2,3-dimethylimidazolium tetrafluoroborate, 99%

CAS: 402846-78-0 Molecular Formula: C9H17BF4N2 Molecular Weight (g/mol): 240.05 MDL Number: MFCD03427618 InChI Key: VCAIYEJBOWHUGP-UHFFFAOYSA-N Synonym: 1-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-n-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-butyl-2,3-dimethylimidazol-1-ium tetrafluoroborate,3-butyl-1,2-dimethylimidazol-1-ium tetrafluoroborate,bdmim bf4,acmc-209jcq,dsstox_cid_27885,dsstox_rid_82638,dsstox_gsid_47909,ksc235m3b PubChem CID: 2734244 IUPAC Name: 1-butyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate SMILES: F[B-](F)(F)F.CCCCN1C=C[N+](C)=C1C

PubChem CID 2734244
CAS 402846-78-0
Molecular Weight (g/mol) 240.05
MDL Number MFCD03427618
SMILES F[B-](F)(F)F.CCCCN1C=C[N+](C)=C1C
Synonym 1-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-n-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-butyl-2,3-dimethylimidazol-1-ium tetrafluoroborate,3-butyl-1,2-dimethylimidazol-1-ium tetrafluoroborate,bdmim bf4,acmc-209jcq,dsstox_cid_27885,dsstox_rid_82638,dsstox_gsid_47909,ksc235m3b
IUPAC Name 1-butyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate
InChI Key VCAIYEJBOWHUGP-UHFFFAOYSA-N
Molecular Formula C9H17BF4N2
563

5-Chloro-1-Methyl-4-Nitroimidazole, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

564

1H-Pyrazole, 98%

CAS: 288-13-1 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.079 MDL Number: MFCD00005234 InChI Key: WTKZEGDFNFYCGP-UHFFFAOYSA-N Synonym: pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1 PubChem CID: 1048 ChEBI: CHEBI:17241 IUPAC Name: 1H-pyrazole SMILES: C1=CNN=C1

PubChem CID 1048
CAS 288-13-1
Molecular Weight (g/mol) 68.079
ChEBI CHEBI:17241
MDL Number MFCD00005234
SMILES C1=CNN=C1
Synonym pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1
IUPAC Name 1H-pyrazole
InChI Key WTKZEGDFNFYCGP-UHFFFAOYSA-N
Molecular Formula C3H4N2
565

3-Benzyl-5-(2-hydroxyethyl)-4-methylthiazolium chloride, 98%

CAS: 4568-71-2 Molecular Formula: C13H16ClNOS Molecular Weight (g/mol): 269.79 MDL Number: MFCD00011959 InChI Key: IWSVLBKHBJGMAA-UHFFFAOYSA-M Synonym: 3-benzyl-5-2-hydroxyethyl-4-methylthiazolium chloride,3-benzyl-5-2-hydroxyethyl-4-methylthiazol-3-ium chloride,3-benzyl-5-2-hydroxyethyl-4-methyl-1,3-thiazol-3-ium chloride,thiazolium, 5-2-hydroxyethyl-4-methyl-3-phenylmethyl-, chloride,2-4-methyl-3-benzyl-1,3-thiazol-5-yl ethan-1-ol, chloride,acmc-1aqyn,3-benzyl-5-2-hydroxyethyl thazolium chloride,3-benzyl-4-methyl-5-hydroxyethylthiazolium chloride,3-benzyl-5-hydroxyethyl-4-methylthiazolium chloride,3-benzyl-5 2-hydroxyethyl-4-methylthiazolium chloride PubChem CID: 2833352 IUPAC Name: 2-(3-benzyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol;chloride SMILES: [Cl-].CC1=C(CCO)SC=[N+]1CC1=CC=CC=C1

PubChem CID 2833352
CAS 4568-71-2
Molecular Weight (g/mol) 269.79
MDL Number MFCD00011959
SMILES [Cl-].CC1=C(CCO)SC=[N+]1CC1=CC=CC=C1
Synonym 3-benzyl-5-2-hydroxyethyl-4-methylthiazolium chloride,3-benzyl-5-2-hydroxyethyl-4-methylthiazol-3-ium chloride,3-benzyl-5-2-hydroxyethyl-4-methyl-1,3-thiazol-3-ium chloride,thiazolium, 5-2-hydroxyethyl-4-methyl-3-phenylmethyl-, chloride,2-4-methyl-3-benzyl-1,3-thiazol-5-yl ethan-1-ol, chloride,acmc-1aqyn,3-benzyl-5-2-hydroxyethyl thazolium chloride,3-benzyl-4-methyl-5-hydroxyethylthiazolium chloride,3-benzyl-5-hydroxyethyl-4-methylthiazolium chloride,3-benzyl-5 2-hydroxyethyl-4-methylthiazolium chloride
IUPAC Name 2-(3-benzyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol;chloride
InChI Key IWSVLBKHBJGMAA-UHFFFAOYSA-M
Molecular Formula C13H16ClNOS
566

4-(1H-1,2,4-triazol-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™

CAS: 112809-25-3 Molecular Formula: C10H8N4 Molecular Weight (g/mol): 184.202 MDL Number: MFCD07368016 InChI Key: HQLYWHSJALKYOV-UHFFFAOYSA-N Synonym: 4-1h-1,2,4-triazol-1-ylmethyl benzonitrile,4-1h-1,2,4-triazol-1-yl methyl benzonitrile,4-1h-1,2,4-triazolylmethyl benzonitrile,4-1,2,4-triazol-1-ylmethyl benzonitrile,benzonitrile, 4-1h-1,2,4-triazol-1-ylmethyl,4-1,2,4-triazol-1-yl methyl benzonitrile,4-1-1,2,4-triazolyl methyl benzontrile,4-1,2,4-triazolylmethyl benzenecarbonitrile,letrozole impurity c PubChem CID: 7537616 IUPAC Name: 4-(1,2,4-triazol-1-ylmethyl)benzonitrile SMILES: C1=CC(=CC=C1CN2C=NC=N2)C#N

PubChem CID 7537616
CAS 112809-25-3
Molecular Weight (g/mol) 184.202
MDL Number MFCD07368016
SMILES C1=CC(=CC=C1CN2C=NC=N2)C#N
Synonym 4-1h-1,2,4-triazol-1-ylmethyl benzonitrile,4-1h-1,2,4-triazol-1-yl methyl benzonitrile,4-1h-1,2,4-triazolylmethyl benzonitrile,4-1,2,4-triazol-1-ylmethyl benzonitrile,benzonitrile, 4-1h-1,2,4-triazol-1-ylmethyl,4-1,2,4-triazol-1-yl methyl benzonitrile,4-1-1,2,4-triazolyl methyl benzontrile,4-1,2,4-triazolylmethyl benzenecarbonitrile,letrozole impurity c
IUPAC Name 4-(1,2,4-triazol-1-ylmethyl)benzonitrile
InChI Key HQLYWHSJALKYOV-UHFFFAOYSA-N
Molecular Formula C10H8N4
567

5-Nitro-1H-indazole, 98+%

CAS: 5401-94-5 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.136 MDL Number: MFCD00005693 InChI Key: WSGURAYTCUVDQL-UHFFFAOYSA-N Synonym: 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol PubChem CID: 21501 IUPAC Name: 5-nitro-1H-indazole SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C=NN2

PubChem CID 21501
CAS 5401-94-5
Molecular Weight (g/mol) 163.136
MDL Number MFCD00005693
SMILES C1=CC2=C(C=C1[N+](=O)[O-])C=NN2
Synonym 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol
IUPAC Name 5-nitro-1H-indazole
InChI Key WSGURAYTCUVDQL-UHFFFAOYSA-N
Molecular Formula C7H5N3O2
568

5-(2-Bromophenyl)-1,3-oxazole, ≥97%, Thermo Scientific™

CAS: 328270-70-8 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 MDL Number: MFCD05668985 InChI Key: JLTHLCLAPCIKJJ-UHFFFAOYSA-N Synonym: 5-2-bromophenyl oxazole,5-2-bromophenyl-1,3-oxazole,oxazole,5-2-bromophenyl PubChem CID: 3780551 IUPAC Name: 5-(2-bromophenyl)-1,3-oxazole SMILES: C1=CC=C(C(=C1)C2=CN=CO2)Br

PubChem CID 3780551
CAS 328270-70-8
Molecular Weight (g/mol) 224.057
MDL Number MFCD05668985
SMILES C1=CC=C(C(=C1)C2=CN=CO2)Br
Synonym 5-2-bromophenyl oxazole,5-2-bromophenyl-1,3-oxazole,oxazole,5-2-bromophenyl
IUPAC Name 5-(2-bromophenyl)-1,3-oxazole
InChI Key JLTHLCLAPCIKJJ-UHFFFAOYSA-N
Molecular Formula C9H6BrNO
569

1,2,5-Oxadiazole-3-carboxylic acid, ≥97%, Thermo Scientific™

CAS: 88598-08-7 Molecular Formula: C3H2N2O3 Molecular Weight (g/mol): 114.06 MDL Number: MFCD00604386 InChI Key: JBLHCUQCDKBPGY-UHFFFAOYSA-N Synonym: furazan-3-carboxylic acid,3-carboxy-1,2,5-oxadiazole,1,2,5-oxadiazole-3-carboxylicacid,acmc-1bkac,1,2,5-oxadiazole, oxd4,9ci PubChem CID: 1415524 IUPAC Name: 1,2,5-oxadiazole-3-carboxylic acid SMILES: OC(=O)C1=NON=C1

PubChem CID 1415524
CAS 88598-08-7
Molecular Weight (g/mol) 114.06
MDL Number MFCD00604386
SMILES OC(=O)C1=NON=C1
Synonym furazan-3-carboxylic acid,3-carboxy-1,2,5-oxadiazole,1,2,5-oxadiazole-3-carboxylicacid,acmc-1bkac,1,2,5-oxadiazole, oxd4,9ci
IUPAC Name 1,2,5-oxadiazole-3-carboxylic acid
InChI Key JBLHCUQCDKBPGY-UHFFFAOYSA-N
Molecular Formula C3H2N2O3
570

1-Ethyl-3-methylimidazolium chloride, 97%

CAS: 65039-09-0 Molecular Formula: C6H11ClN2 Molecular Weight (g/mol): 146.62 MDL Number: MFCD00074843 InChI Key: BMQZYMYBQZGEEY-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium chloride,1-ethyl-3-methyl-1h-imidazol-3-ium chloride,emim cl,unii-ph90aq1e93,1-ethyl-3-methylimidazoliumchloride,1-methyl-3-ethylimidazolium chloride,1-ethyl-3-methylimidazol-3-ium chloride,emim-cl,basionics™ st 80,dsstox_cid_21180 PubChem CID: 2734160 ChEBI: CHEBI:61327 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;chloride SMILES: [Cl-].CCN1C=C[N+](C)=C1

PubChem CID 2734160
CAS 65039-09-0
Molecular Weight (g/mol) 146.62
ChEBI CHEBI:61327
MDL Number MFCD00074843
SMILES [Cl-].CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium chloride,1-ethyl-3-methyl-1h-imidazol-3-ium chloride,emim cl,unii-ph90aq1e93,1-ethyl-3-methylimidazoliumchloride,1-methyl-3-ethylimidazolium chloride,1-ethyl-3-methylimidazol-3-ium chloride,emim-cl,basionics™ st 80,dsstox_cid_21180
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;chloride
InChI Key BMQZYMYBQZGEEY-UHFFFAOYSA-M
Molecular Formula C6H11ClN2