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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 (2,683)
Thiazoles (1,750)
Pyrazoles (1,341)
Triazoles (569)
Oxazoles (506)
Isoxazoles (234)
Oxadiazoles (223)
Thiadiazoles (68)
Dithiazoles (4)

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211 – 225 of 6,131 results
211

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

CAS: 179057-34-2 Molecular Formula: C11H9N3 Molecular Weight (g/mol): 183.214 MDL Number: MFCD07687291 InChI Key: FPZADNOIMZEBTC-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-ylmethyl benzonitrile,4-pyrazol-1-ylmethyl benzonitrile,benzonitrile,4-1h-pyrazol-1-ylmethyl,4-1h-pyrazol-1-yl methyl benzonitrile,4-pyrazolylmethyl benzenecarbonitrile,4-1h-pyrazole-1-ylmethyl benzonitrile PubChem CID: 8834695 IUPAC Name: 4-(pyrazol-1-ylmethyl)benzonitrile SMILES: C1=CN(N=C1)CC2=CC=C(C=C2)C#N

PubChem CID 8834695
CAS 179057-34-2
Molecular Weight (g/mol) 183.214
MDL Number MFCD07687291
SMILES C1=CN(N=C1)CC2=CC=C(C=C2)C#N
Synonym 4-1h-pyrazol-1-ylmethyl benzonitrile,4-pyrazol-1-ylmethyl benzonitrile,benzonitrile,4-1h-pyrazol-1-ylmethyl,4-1h-pyrazol-1-yl methyl benzonitrile,4-pyrazolylmethyl benzenecarbonitrile,4-1h-pyrazole-1-ylmethyl benzonitrile
IUPAC Name 4-(pyrazol-1-ylmethyl)benzonitrile
InChI Key FPZADNOIMZEBTC-UHFFFAOYSA-N
Molecular Formula C11H9N3
212

4-Methyl-2-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole, 97%, Thermo Scientific™

CAS: 690632-24-7 Molecular Formula: C16H20BNO2S Molecular Weight (g/mol): 301.21 MDL Number: MFCD05865106 InChI Key: QJROOQWDMKQWEZ-UHFFFAOYSA-N Synonym: 4-methyl-2-phenyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1,3-thiazole,4-methyl-2-phenyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl-1,3-thiazole,4-methyl-2-phenyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thiazole,4-methyl-2-phenyl-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1,3-thiazole PubChem CID: 2795497 IUPAC Name: 4-methyl-2-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole SMILES: CC1=C(SC(=N1)C1=CC=CC=C1)B1OC(C)(C)C(C)(C)O1

PubChem CID 2795497
CAS 690632-24-7
Molecular Weight (g/mol) 301.21
MDL Number MFCD05865106
SMILES CC1=C(SC(=N1)C1=CC=CC=C1)B1OC(C)(C)C(C)(C)O1
Synonym 4-methyl-2-phenyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1,3-thiazole,4-methyl-2-phenyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl-1,3-thiazole,4-methyl-2-phenyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thiazole,4-methyl-2-phenyl-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1,3-thiazole
IUPAC Name 4-methyl-2-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
InChI Key QJROOQWDMKQWEZ-UHFFFAOYSA-N
Molecular Formula C16H20BNO2S
213

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

CAS: 584-13-4 Molecular Formula: C2H4N4 Molecular Weight (g/mol): 84.082 MDL Number: MFCD00003099 InChI Key: FMCUPJKTGNBGEC-UHFFFAOYSA-N Synonym: 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

PubChem CID 11432
CAS 584-13-4
Molecular Weight (g/mol) 84.082
MDL Number MFCD00003099
SMILES C1=NN=CN1N
Synonym 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
IUPAC Name 1,2,4-triazol-4-amine
InChI Key FMCUPJKTGNBGEC-UHFFFAOYSA-N
Molecular Formula C2H4N4
214

2-Phenylbenzoxazole, 99%

CAS: 833-50-1 Molecular Formula: C13H9NO Molecular Weight (g/mol): 195.221 MDL Number: MFCD00012183 InChI Key: FIISKTXZUZBTRC-UHFFFAOYSA-N Synonym: 2-phenylbenzoxazole,2-phenylbenzo d oxazole,benzoxazole, 2-phenyl,ccris 7874,phenyl-2 benzoxazole french,2-phenyl-benzoxazole,phenyl-2 benzoxazole,2-phenybenzoxazole,2-phenyl benzoxazole,2-phenyl-benzooxazole PubChem CID: 70030 IUPAC Name: 2-phenyl-1,3-benzoxazole SMILES: C1=CC=C(C=C1)C2=NC3=CC=CC=C3O2

PubChem CID 70030
CAS 833-50-1
Molecular Weight (g/mol) 195.221
MDL Number MFCD00012183
SMILES C1=CC=C(C=C1)C2=NC3=CC=CC=C3O2
Synonym 2-phenylbenzoxazole,2-phenylbenzo d oxazole,benzoxazole, 2-phenyl,ccris 7874,phenyl-2 benzoxazole french,2-phenyl-benzoxazole,phenyl-2 benzoxazole,2-phenybenzoxazole,2-phenyl benzoxazole,2-phenyl-benzooxazole
IUPAC Name 2-phenyl-1,3-benzoxazole
InChI Key FIISKTXZUZBTRC-UHFFFAOYSA-N
Molecular Formula C13H9NO
215

2-(4-Pyridyl)thiazole-4-carboxylic acid, 97%

CAS: 21278-86-4 Molecular Formula: C9H5N2O2S Molecular Weight (g/mol): 205.21 MDL Number: MFCD00171745 InChI Key: COOQMBOJAAZEIR-UHFFFAOYSA-M Synonym: 2-pyridin-4-yl thiazole-4-carboxylic acid,2-4-pyridyl thiazole-4-carboxylic acid,2-pyridin-4-yl-1,3-thiazole-4-carboxylic acid,2-4-pyridyl-1,3-thiazole-4-carboxylic acid,2-4-pyridinyl-1,3-thiazole-4-carboxylic acid,2-pyridin-4-yl-thiazole-4-carboxylic acid,4-thiazolecarboxylicacid, 2-4-pyridinyl,acmc-1cr1v,4-thiazolecarboxylic acid, 2-4-pyridinyl,4-carboxy-2-4-pyridyl thiazole PubChem CID: 716091 SMILES: [O-]C(=O)C1=CSC(=N1)C1=CC=NC=C1

PubChem CID 716091
CAS 21278-86-4
Molecular Weight (g/mol) 205.21
MDL Number MFCD00171745
SMILES [O-]C(=O)C1=CSC(=N1)C1=CC=NC=C1
Synonym 2-pyridin-4-yl thiazole-4-carboxylic acid,2-4-pyridyl thiazole-4-carboxylic acid,2-pyridin-4-yl-1,3-thiazole-4-carboxylic acid,2-4-pyridyl-1,3-thiazole-4-carboxylic acid,2-4-pyridinyl-1,3-thiazole-4-carboxylic acid,2-pyridin-4-yl-thiazole-4-carboxylic acid,4-thiazolecarboxylicacid, 2-4-pyridinyl,acmc-1cr1v,4-thiazolecarboxylic acid, 2-4-pyridinyl,4-carboxy-2-4-pyridyl thiazole
InChI Key COOQMBOJAAZEIR-UHFFFAOYSA-M
Molecular Formula C9H5N2O2S
216

2-Bromothiazole-5-carboxylic acid, 97%

CAS: 54045-76-0 Molecular Formula: C4H2BrNO2S Molecular Weight (g/mol): 208.029 MDL Number: MFCD04115730 InChI Key: BESGTWHUMYHYEQ-UHFFFAOYSA-N Synonym: 2-bromothiazole-5-carboxylic acid,2-bromo-5-thiazolecarboxylic acid,2-bromo-5-thiazolecarboxylicacid,2-bromo-thiazole-5-carboxylic acid,2-bromo-5-carboxythiazole,5-thiazolecarboxylic acid, 2-bromo,2-bromthiazol-5-carboxylic acid,pubchem15963,acmc-1ap3n,2-bromothiazole-5-carboxylic PubChem CID: 2763210 IUPAC Name: 2-bromo-1,3-thiazole-5-carboxylic acid SMILES: C1=C(SC(=N1)Br)C(=O)O

PubChem CID 2763210
CAS 54045-76-0
Molecular Weight (g/mol) 208.029
MDL Number MFCD04115730
SMILES C1=C(SC(=N1)Br)C(=O)O
Synonym 2-bromothiazole-5-carboxylic acid,2-bromo-5-thiazolecarboxylic acid,2-bromo-5-thiazolecarboxylicacid,2-bromo-thiazole-5-carboxylic acid,2-bromo-5-carboxythiazole,5-thiazolecarboxylic acid, 2-bromo,2-bromthiazol-5-carboxylic acid,pubchem15963,acmc-1ap3n,2-bromothiazole-5-carboxylic
IUPAC Name 2-bromo-1,3-thiazole-5-carboxylic acid
InChI Key BESGTWHUMYHYEQ-UHFFFAOYSA-N
Molecular Formula C4H2BrNO2S
217

ethyle2-mercapto-1H-imidazole-4-carboxylate, 97%, Thermo Scientific™

CAS: 64038-64-8 Molecular Formula: C6H8N2O2S Molecular Weight (g/mol): 172.202 MDL Number: MFCD00068042 InChI Key: PONOGPICUOALRU-UHFFFAOYSA-N Synonym: ethyl 2-mercapto-1h-imidazole-4-carboxylate,4-ethoxycarbonylimidazole-2-thiol,usaf el-63,imidazole-2-thiol, 5-ethoxycarbonyl,2-mercapto-5-carbethoxyimidazole,imidazole, 2-mercapto-5-carbethoxy,ethyl 2-sulfanyl-1h-imidazole-4-carboxylate,2-mercapto-1h-imidazole-4-carboxylic acid ethyl ester,ethyl 2-mercaptoimidazole-4-carboxylate,maybridge1_005066 PubChem CID: 2736338 IUPAC Name: ethyl 2-sulfanylidene-1,3-dihydroimidazole-4-carboxylate SMILES: CCOC(=O)C1=CNC(=S)N1

PubChem CID 2736338
CAS 64038-64-8
Molecular Weight (g/mol) 172.202
MDL Number MFCD00068042
SMILES CCOC(=O)C1=CNC(=S)N1
Synonym ethyl 2-mercapto-1h-imidazole-4-carboxylate,4-ethoxycarbonylimidazole-2-thiol,usaf el-63,imidazole-2-thiol, 5-ethoxycarbonyl,2-mercapto-5-carbethoxyimidazole,imidazole, 2-mercapto-5-carbethoxy,ethyl 2-sulfanyl-1h-imidazole-4-carboxylate,2-mercapto-1h-imidazole-4-carboxylic acid ethyl ester,ethyl 2-mercaptoimidazole-4-carboxylate,maybridge1_005066
IUPAC Name ethyl 2-sulfanylidene-1,3-dihydroimidazole-4-carboxylate
InChI Key PONOGPICUOALRU-UHFFFAOYSA-N
Molecular Formula C6H8N2O2S
218

1-n-Hexyl-3-methylimidazolium chloride, 98%

CAS: 171058-17-6 Molecular Formula: C10H19N2 Molecular Weight (g/mol): 167.28 MDL Number: MFCD03093289 InChI Key: RVEJOWGVUQQIIZ-UHFFFAOYSA-N Synonym: 1-hexyl-3-methylimidazolium chloride,hmimcl,1-hexyl-3-methyl-1h-imidazol-3-ium chloride,1-hexyl-3-methylimidazol-3-ium chloride,hmim cl,acmc-209e2c,dsstox_cid_27924,dsstox_rid_82677,dsstox_gsid_47948,ksc491c7f PubChem CID: 2734163 ChEBI: CHEBI:61340 IUPAC Name: 1-hexyl-3-methylimidazol-3-ium;chloride SMILES: CCCCCC[N+]1=CN(C)C=C1

PubChem CID 2734163
CAS 171058-17-6
Molecular Weight (g/mol) 167.28
ChEBI CHEBI:61340
MDL Number MFCD03093289
SMILES CCCCCC[N+]1=CN(C)C=C1
Synonym 1-hexyl-3-methylimidazolium chloride,hmimcl,1-hexyl-3-methyl-1h-imidazol-3-ium chloride,1-hexyl-3-methylimidazol-3-ium chloride,hmim cl,acmc-209e2c,dsstox_cid_27924,dsstox_rid_82677,dsstox_gsid_47948,ksc491c7f
IUPAC Name 1-hexyl-3-methylimidazol-3-ium;chloride
InChI Key RVEJOWGVUQQIIZ-UHFFFAOYSA-N
Molecular Formula C10H19N2
219

1-methyl-1h-indazole-3-carbonyl chloride, 97%, Thermo Scientific™

CAS: 106649-02-9 Molecular Formula: C9H7ClN2O Molecular Weight (g/mol): 194.62 MDL Number: MFCD02093096 InChI Key: NPNWVMBPSINFBV-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carbonyl chloride,1h-indazole-3-carbonylchloride, 1-methyl,1-methyl-1h-indazol-3-carbonyl chloride,1h-indazole-3-carbonyl chloride, 1-methyl,acmc-20mac8,1-methyl-3-indazolylcarbonyl chloride,1-methyl-indazole-3-carbonyl chloride,1-methyl-1h-indazole-3-carboxychloride,1-methyl-1h-indazole-3-carboxylic acid chloride PubChem CID: 7022055 IUPAC Name: 1-methylindazole-3-carbonyl chloride SMILES: CN1N=C(C(Cl)=O)C2=CC=CC=C12

PubChem CID 7022055
CAS 106649-02-9
Molecular Weight (g/mol) 194.62
MDL Number MFCD02093096
SMILES CN1N=C(C(Cl)=O)C2=CC=CC=C12
Synonym 1-methyl-1h-indazole-3-carbonyl chloride,1h-indazole-3-carbonylchloride, 1-methyl,1-methyl-1h-indazol-3-carbonyl chloride,1h-indazole-3-carbonyl chloride, 1-methyl,acmc-20mac8,1-methyl-3-indazolylcarbonyl chloride,1-methyl-indazole-3-carbonyl chloride,1-methyl-1h-indazole-3-carboxychloride,1-methyl-1h-indazole-3-carboxylic acid chloride
IUPAC Name 1-methylindazole-3-carbonyl chloride
InChI Key NPNWVMBPSINFBV-UHFFFAOYSA-N
Molecular Formula C9H7ClN2O
220

3-(Chloromethyl)-5-(2-furyl)isoxazole, ≥97%, Thermo Scientific™

CAS: 848658-70-8 Molecular Formula: C8H6ClNO2 Molecular Weight (g/mol): 183.591 MDL Number: MFCD07329988 InChI Key: IPIMDVOPXIOKAK-UHFFFAOYSA-N Synonym: 3-chloromethyl-5-2-furyl isoxazole,3-chloromethyl-5-furan-2-yl-1,2-oxazole,isoxazole,3-chloromethyl-5-2-furanyl,3-chloromethyl-5-furan-2-yl isoxazole PubChem CID: 4962799 IUPAC Name: 3-(chloromethyl)-5-(furan-2-yl)-1,2-oxazole SMILES: C1=COC(=C1)C2=CC(=NO2)CCl

PubChem CID 4962799
CAS 848658-70-8
Molecular Weight (g/mol) 183.591
MDL Number MFCD07329988
SMILES C1=COC(=C1)C2=CC(=NO2)CCl
Synonym 3-chloromethyl-5-2-furyl isoxazole,3-chloromethyl-5-furan-2-yl-1,2-oxazole,isoxazole,3-chloromethyl-5-2-furanyl,3-chloromethyl-5-furan-2-yl isoxazole
IUPAC Name 3-(chloromethyl)-5-(furan-2-yl)-1,2-oxazole
InChI Key IPIMDVOPXIOKAK-UHFFFAOYSA-N
Molecular Formula C8H6ClNO2
221

4-Phenyl-1,2,3-thiadiazole-5-carboxylic acid, 97%, Thermo Scientific™

CAS: 78875-63-5 Molecular Formula: C9H6N2O2S Molecular Weight (g/mol): 206.219 MDL Number: MFCD00052216 InChI Key: DQZLGXDVESJWKA-UHFFFAOYSA-N Synonym: 4-phenyl-1,2,3-thiadiazole-5-carboxylic acid,1,2,3-thiadiazole-5-carboxylic acid, 4-phenyl,4-phenyl-5-thiadiazolecarboxylic acid,5-carboxy-4-phenyl-1,2,3-thiadiazole,4-phenyl-1,2,3-thiadiazol-5-carboxylic acid,4-phenyl 1,2,3 thiadiazole-5-carboxylic acid,1,2,3-thiadiazole-5-carboxylicacid, 4-phenyl,4-phenyl-1,2,3 thiadiazole-5-carboxylic acid PubChem CID: 2737167 IUPAC Name: 4-phenylthiadiazole-5-carboxylic acid SMILES: C1=CC=C(C=C1)C2=C(SN=N2)C(=O)O

PubChem CID 2737167
CAS 78875-63-5
Molecular Weight (g/mol) 206.219
MDL Number MFCD00052216
SMILES C1=CC=C(C=C1)C2=C(SN=N2)C(=O)O
Synonym 4-phenyl-1,2,3-thiadiazole-5-carboxylic acid,1,2,3-thiadiazole-5-carboxylic acid, 4-phenyl,4-phenyl-5-thiadiazolecarboxylic acid,5-carboxy-4-phenyl-1,2,3-thiadiazole,4-phenyl-1,2,3-thiadiazol-5-carboxylic acid,4-phenyl 1,2,3 thiadiazole-5-carboxylic acid,1,2,3-thiadiazole-5-carboxylicacid, 4-phenyl,4-phenyl-1,2,3 thiadiazole-5-carboxylic acid
IUPAC Name 4-phenylthiadiazole-5-carboxylic acid
InChI Key DQZLGXDVESJWKA-UHFFFAOYSA-N
Molecular Formula C9H6N2O2S
222

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.

223

Metronidazole, 99.32%, MP Biomedicals™

CAS: 443-48-1 Molecular Formula: C6H9N3O3 Molecular Weight (g/mol): 171.156 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
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
224

Miconazole Impurity A, 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.

225

5-(Chloromethyl)-3-(2-thienyl)-1,2,4-oxadiazole, ≥95%, Thermo Scientific™

CAS: 63417-81-2 Molecular Formula: C7H5ClN2OS Molecular Weight (g/mol): 200.64 MDL Number: MFCD03407322 InChI Key: YOUDLOUFERNGRO-UHFFFAOYSA-N Synonym: 5-chloromethyl-3-2-thienyl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4-oxadiazole,1,2,4-oxadiazole,5-chloromethyl-3-2-thienyl,5-chloromethyl-3-thien-2-yl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadiazole,2-5-chloromethyl-1,2,4-oxadiazol-3-yl thiophene,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadia zole PubChem CID: 736830 IUPAC Name: 5-(chloromethyl)-3-thiophen-2-yl-1,2,4-oxadiazole SMILES: ClCC1=NC(=NO1)C1=CC=CS1

PubChem CID 736830
CAS 63417-81-2
Molecular Weight (g/mol) 200.64
MDL Number MFCD03407322
SMILES ClCC1=NC(=NO1)C1=CC=CS1
Synonym 5-chloromethyl-3-2-thienyl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4-oxadiazole,1,2,4-oxadiazole,5-chloromethyl-3-2-thienyl,5-chloromethyl-3-thien-2-yl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadiazole,2-5-chloromethyl-1,2,4-oxadiazol-3-yl thiophene,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadia zole
IUPAC Name 5-(chloromethyl)-3-thiophen-2-yl-1,2,4-oxadiazole
InChI Key YOUDLOUFERNGRO-UHFFFAOYSA-N
Molecular Formula C7H5ClN2OS