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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 (2,073)
Thiazoles (1,143)
Pyrazoles (905)
Triazoles (506)
Oxazoles (308)
Isoxazoles (233)
Oxadiazoles (150)
Thiadiazoles (69)
Dithiazoles (4)

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301 – 315 of 4,157 results
301

3-Amino-5-bromo-1-methyl-1H-indazole, 97%

CAS: 1000018-06-3 Molecular Formula: C8H8BrN3 Molecular Weight (g/mol): 226.077 MDL Number: MFCD09864804 InChI Key: BKBSBRJIGMVBFM-UHFFFAOYSA-N Synonym: 5-bromo-1-methyl-1h-indazol-3-amine,3-amino-5-bromo-1-methyl-1h-indazole,acmc-2097ln,5-bromo-1-methyl-1h-indazole-3-ylamine PubChem CID: 26369215 IUPAC Name: 5-bromo-1-methylindazol-3-amine SMILES: CN1C2=C(C=C(C=C2)Br)C(=N1)N

PubChem CID 26369215
CAS 1000018-06-3
Molecular Weight (g/mol) 226.077
MDL Number MFCD09864804
SMILES CN1C2=C(C=C(C=C2)Br)C(=N1)N
Synonym 5-bromo-1-methyl-1h-indazol-3-amine,3-amino-5-bromo-1-methyl-1h-indazole,acmc-2097ln,5-bromo-1-methyl-1h-indazole-3-ylamine
IUPAC Name 5-bromo-1-methylindazol-3-amine
InChI Key BKBSBRJIGMVBFM-UHFFFAOYSA-N
Molecular Formula C8H8BrN3
302

3-Amino-5-phenyl-1,2,4-thiadiazole, 96%

CAS: 27182-54-3 Molecular Formula: C8H7N3S Molecular Weight (g/mol): 177.225 MDL Number: MFCD00159799 InChI Key: WOZDQVLZCXNJPY-UHFFFAOYSA-N Synonym: 3-amino-5-phenyl-1,2,4-thiadiazole,1,2,4-thiadiazol-3-amine, 5-phenyl,5-phenyl-1,2,4-thiadiazol-3-yl-amine,5-phenyl-1,2,4-thiadiazole-3-amine,# PubChem CID: 554203 IUPAC Name: 5-phenyl-1,2,4-thiadiazol-3-amine SMILES: C1=CC=C(C=C1)C2=NC(=NS2)N

PubChem CID 554203
CAS 27182-54-3
Molecular Weight (g/mol) 177.225
MDL Number MFCD00159799
SMILES C1=CC=C(C=C1)C2=NC(=NS2)N
Synonym 3-amino-5-phenyl-1,2,4-thiadiazole,1,2,4-thiadiazol-3-amine, 5-phenyl,5-phenyl-1,2,4-thiadiazol-3-yl-amine,5-phenyl-1,2,4-thiadiazole-3-amine,#
IUPAC Name 5-phenyl-1,2,4-thiadiazol-3-amine
InChI Key WOZDQVLZCXNJPY-UHFFFAOYSA-N
Molecular Formula C8H7N3S
303

3-Trifluoromethyl-1H-pyrazole, 97%

CAS: 20154-03-4 Molecular Formula: C4H3F3N2 Molecular Weight (g/mol): 136.077 MDL Number: MFCD00115018 InChI Key: PYXNITNKYBLBMW-UHFFFAOYSA-N Synonym: 3-trifluoromethyl pyrazole,3-trifluoromethyl-1h-pyrazole,5-trifluoromethyl-1h-pyrazole,3-trifluoromethylpyrazole,trifluoromethylpyrazole,1h-pyrazole, 3-trifluoromethyl,3-trifluoromethyl-2h-pyrazole,pubchem10164,pubchem10423 PubChem CID: 1807034 IUPAC Name: 5-(trifluoromethyl)-1H-pyrazole SMILES: C1=C(NN=C1)C(F)(F)F

PubChem CID 1807034
CAS 20154-03-4
Molecular Weight (g/mol) 136.077
MDL Number MFCD00115018
SMILES C1=C(NN=C1)C(F)(F)F
Synonym 3-trifluoromethyl pyrazole,3-trifluoromethyl-1h-pyrazole,5-trifluoromethyl-1h-pyrazole,3-trifluoromethylpyrazole,trifluoromethylpyrazole,1h-pyrazole, 3-trifluoromethyl,3-trifluoromethyl-2h-pyrazole,pubchem10164,pubchem10423
IUPAC Name 5-(trifluoromethyl)-1H-pyrazole
InChI Key PYXNITNKYBLBMW-UHFFFAOYSA-N
Molecular Formula C4H3F3N2
304

1-n-Butyl-3-methylimidazolium dicyanamide, 97%

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
305

1-Methyl-3-n-octylimidazolium chloride, 97%

CAS: 64697-40-1 Molecular Formula: C12H23ClN2 Molecular Weight (g/mol): 230.78 MDL Number: MFCD03095432 InChI Key: OXFBEEDAZHXDHB-UHFFFAOYSA-M Synonym: 1-methyl-3-n-octylimidazolium chloride,1-methyl-3-octylimidazolium chloride,1-octyl-3-methylimidazolium chloride,3-methyl-1-octylimidazolium chloride,omimcl,acmc-20aj1j,dsstox_cid_27849,dsstox_rid_82602,dsstox_gsid_47873,ksc491c7j PubChem CID: 2734223 ChEBI: CHEBI:61342 IUPAC Name: 1-methyl-3-octylimidazol-1-ium;chloride SMILES: [Cl-].CCCCCCCCN1C=C[N+](C)=C1

PubChem CID 2734223
CAS 64697-40-1
Molecular Weight (g/mol) 230.78
ChEBI CHEBI:61342
MDL Number MFCD03095432
SMILES [Cl-].CCCCCCCCN1C=C[N+](C)=C1
Synonym 1-methyl-3-n-octylimidazolium chloride,1-methyl-3-octylimidazolium chloride,1-octyl-3-methylimidazolium chloride,3-methyl-1-octylimidazolium chloride,omimcl,acmc-20aj1j,dsstox_cid_27849,dsstox_rid_82602,dsstox_gsid_47873,ksc491c7j
IUPAC Name 1-methyl-3-octylimidazol-1-ium;chloride
InChI Key OXFBEEDAZHXDHB-UHFFFAOYSA-M
Molecular Formula C12H23ClN2
306

3-Ethyl-5-(2-hydroxyethyl)-4-methylthiazolium bromide, 98%

CAS: 54016-70-5 Molecular Formula: C8H14BrNOS Molecular Weight (g/mol): 252.17 MDL Number: MFCD00040549 InChI Key: BDQRQMLWZJQQKS-UHFFFAOYSA-M Synonym: 3-ethyl-5-2-hydroxyethyl-4-methylthiazolium bromide,3-ethyl-5-2-hydroxyethyl-4-methylthiazoliumbromide,3-ethyl-5-2-hydroxyethyl-4-methylthiazol-3-ium bromide,thiazolium, 3-ethyl-5-2-hydroxyethyl-4-methyl-, bromide,2-3-ethyl-4-methyl-thiazol-3-ium-5-yl ethanol bromide,3-ethyl-5-2-hydroxyethyl-4-methyl-1,3-thiazol-3-ium bromide,pubchem15236,acmc-1area,ksc272q3h,3ethyl-5-2-hydroxyethyl-4-methylthiazolium bromide PubChem CID: 9964923 IUPAC Name: 2-(3-ethyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol;bromide SMILES: CC[N+]1=CSC(=C1C)CCO.[Br-]

PubChem CID 9964923
CAS 54016-70-5
Molecular Weight (g/mol) 252.17
MDL Number MFCD00040549
SMILES CC[N+]1=CSC(=C1C)CCO.[Br-]
Synonym 3-ethyl-5-2-hydroxyethyl-4-methylthiazolium bromide,3-ethyl-5-2-hydroxyethyl-4-methylthiazoliumbromide,3-ethyl-5-2-hydroxyethyl-4-methylthiazol-3-ium bromide,thiazolium, 3-ethyl-5-2-hydroxyethyl-4-methyl-, bromide,2-3-ethyl-4-methyl-thiazol-3-ium-5-yl ethanol bromide,3-ethyl-5-2-hydroxyethyl-4-methyl-1,3-thiazol-3-ium bromide,pubchem15236,acmc-1area,ksc272q3h,3ethyl-5-2-hydroxyethyl-4-methylthiazolium bromide
IUPAC Name 2-(3-ethyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol;bromide
InChI Key BDQRQMLWZJQQKS-UHFFFAOYSA-M
Molecular Formula C8H14BrNOS
307

4-Bromo-1H-indazole, 97+%

CAS: 186407-74-9 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.035 MDL Number: MFCD05664001 InChI Key: KJIODOACRIRBPB-UHFFFAOYSA-N Synonym: 4-bromoindazole,1h-indazole, 4-bromo,4-bromo 1h indazole,4-bromo-indazole,bromo-1h-indazole,pubchem7834,4-bromo-2h-indazole,acmc-1bzds,4-bromanyl-1h-indazole PubChem CID: 22352548 IUPAC Name: 4-bromo-1H-indazole SMILES: C1=CC2=C(C=NN2)C(=C1)Br

PubChem CID 22352548
CAS 186407-74-9
Molecular Weight (g/mol) 197.035
MDL Number MFCD05664001
SMILES C1=CC2=C(C=NN2)C(=C1)Br
Synonym 4-bromoindazole,1h-indazole, 4-bromo,4-bromo 1h indazole,4-bromo-indazole,bromo-1h-indazole,pubchem7834,4-bromo-2h-indazole,acmc-1bzds,4-bromanyl-1h-indazole
IUPAC Name 4-bromo-1H-indazole
InChI Key KJIODOACRIRBPB-UHFFFAOYSA-N
Molecular Formula C7H5BrN2
308

2-(1-Imidazolyl)acetonitrile, 95%

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
309

5-Chloro-1,2,4-triazolo[4,3-a]pyridine, 97%

CAS: 27187-13-9 Molecular Formula: C6H4ClN3 Molecular Weight (g/mol): 153.57 MDL Number: MFCD11109431 InChI Key: FBQZXTMUYNKLRF-UHFFFAOYSA-N Synonym: 5-chloro-1,2,4 triazolo 4,3-a pyridine,5-chloro-1,2,4-triazolo 4,3-a pyridine,1,2,4-triazolo 4,3-a pyridine, 5-chloro,5-chloro 1,2,4 triazolo 4,3-a pyridine PubChem CID: 324440 IUPAC Name: 5-chloro-[1,2,4]triazolo[4,3-a]pyridine SMILES: ClC1=CC=CC2=NN=CN12

PubChem CID 324440
CAS 27187-13-9
Molecular Weight (g/mol) 153.57
MDL Number MFCD11109431
SMILES ClC1=CC=CC2=NN=CN12
Synonym 5-chloro-1,2,4 triazolo 4,3-a pyridine,5-chloro-1,2,4-triazolo 4,3-a pyridine,1,2,4-triazolo 4,3-a pyridine, 5-chloro,5-chloro 1,2,4 triazolo 4,3-a pyridine
IUPAC Name 5-chloro-[1,2,4]triazolo[4,3-a]pyridine
InChI Key FBQZXTMUYNKLRF-UHFFFAOYSA-N
Molecular Formula C6H4ClN3
310

2,4-Dibromothiazole, 97%

CAS: 4175-77-3 Molecular Formula: C3HBr2NS Molecular Weight (g/mol): 242.916 MDL Number: MFCD01318994 InChI Key: MKEJZKKVVUZXIS-UHFFFAOYSA-N Synonym: 2,4-dibromothiazole,2,4-dibromo thiazole,dibromothiazole,2.4-dibromothiazole,soxlllqacqdfwmijp@,2,4-dibromo-thiazole,acmc-209jll,ksc235o5d,2 pound not4-dibromo-thiazole PubChem CID: 2763297 IUPAC Name: 2,4-dibromo-1,3-thiazole SMILES: C1=C(N=C(S1)Br)Br

PubChem CID 2763297
CAS 4175-77-3
Molecular Weight (g/mol) 242.916
MDL Number MFCD01318994
SMILES C1=C(N=C(S1)Br)Br
Synonym 2,4-dibromothiazole,2,4-dibromo thiazole,dibromothiazole,2.4-dibromothiazole,soxlllqacqdfwmijp@,2,4-dibromo-thiazole,acmc-209jll,ksc235o5d,2 pound not4-dibromo-thiazole
IUPAC Name 2,4-dibromo-1,3-thiazole
InChI Key MKEJZKKVVUZXIS-UHFFFAOYSA-N
Molecular Formula C3HBr2NS
311

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
312

3-Amino-1H-pyrazole-4-carbonitrile, 98%

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
313

3-Amino-1H-pyrazole, 97+%

CAS: 1820-80-0 Molecular Formula: C3H5N3 Molecular Weight (g/mol): 83.094 MDL Number: MFCD00005236 InChI Key: JVVRJMXHNUAPHW-UHFFFAOYSA-N Synonym: 3-aminopyrazole,1h-pyrazol-3-amine,1h-pyrazole-5-amine,5-aminopyrazole,1h-pyrazol-3-ylamine,3-amino-1h-pyrazole,3-aminopyrozole,5-amino-1h-pyrazole,aminopyrazole,3-pyrazolamine PubChem CID: 74561 IUPAC Name: 1H-pyrazol-5-amine SMILES: C1=C(NN=C1)N

PubChem CID 74561
CAS 1820-80-0
Molecular Weight (g/mol) 83.094
MDL Number MFCD00005236
SMILES C1=C(NN=C1)N
Synonym 3-aminopyrazole,1h-pyrazol-3-amine,1h-pyrazole-5-amine,5-aminopyrazole,1h-pyrazol-3-ylamine,3-amino-1h-pyrazole,3-aminopyrozole,5-amino-1h-pyrazole,aminopyrazole,3-pyrazolamine
IUPAC Name 1H-pyrazol-5-amine
InChI Key JVVRJMXHNUAPHW-UHFFFAOYSA-N
Molecular Formula C3H5N3
314

2-Amino-4-phenylthiazole, 98%

CAS: 2010-06-2 Molecular Formula: C9H8N2S Molecular Weight (g/mol): 176.24 MDL Number: MFCD00039680 InChI Key: PYSJLPAOBIGQPK-UHFFFAOYSA-N Synonym: 4-phenylthiazol-2-amine,2-amino-4-phenylthiazole,phenthiazamine,2-thiazolamine, 4-phenyl,4-phenyl-2-thiazolamine,thiazole, 2-amino-4-phenyl,4-phenyl-thiazol-2-ylamine,4-phenyl-2-thiazolylamine,2-amino-4-phenyl-1,3-thiazole,4-phenyl-2-aminothiazole PubChem CID: 40302 IUPAC Name: 4-phenyl-1,3-thiazol-2-amine SMILES: C1=CC=C(C=C1)C2=CSC(=N2)N

PubChem CID 40302
CAS 2010-06-2
Molecular Weight (g/mol) 176.24
MDL Number MFCD00039680
SMILES C1=CC=C(C=C1)C2=CSC(=N2)N
Synonym 4-phenylthiazol-2-amine,2-amino-4-phenylthiazole,phenthiazamine,2-thiazolamine, 4-phenyl,4-phenyl-2-thiazolamine,thiazole, 2-amino-4-phenyl,4-phenyl-thiazol-2-ylamine,4-phenyl-2-thiazolylamine,2-amino-4-phenyl-1,3-thiazole,4-phenyl-2-aminothiazole
IUPAC Name 4-phenyl-1,3-thiazol-2-amine
InChI Key PYSJLPAOBIGQPK-UHFFFAOYSA-N
Molecular Formula C9H8N2S
315

2-Methoxy-4-(tri-n-butylstannyl)thiazole, 96%, Thermo Scientific™

CAS: 927391-09-1 Molecular Formula: C16H31NOSSn Molecular Weight (g/mol): 404.2 MDL Number: MFCD07787372 InChI Key: JCZRGWAGRPABLT-UHFFFAOYSA-N Synonym: 2-methoxy-4-tributylstannyl thiazole,2-methoxy-4-tributylstannyl-1,3-thiazole,4-tributylstannyl-2-methoxythiazole,acmc-209rha,tributyl-2-methoxy-1,3-thiazol-4-yl stannane,2-methoxy-4-tri-n-butylstannyl thiazole,4-tri-n-butylstannyl-2-methoxy-1,3-thiazole PubChem CID: 2763264 IUPAC Name: tributyl-(2-methoxy-1,3-thiazol-4-yl)stannane SMILES: CCCC[Sn](CCCC)(CCCC)C1=CSC(=N1)OC

PubChem CID 2763264
CAS 927391-09-1
Molecular Weight (g/mol) 404.2
MDL Number MFCD07787372
SMILES CCCC[Sn](CCCC)(CCCC)C1=CSC(=N1)OC
Synonym 2-methoxy-4-tributylstannyl thiazole,2-methoxy-4-tributylstannyl-1,3-thiazole,4-tributylstannyl-2-methoxythiazole,acmc-209rha,tributyl-2-methoxy-1,3-thiazol-4-yl stannane,2-methoxy-4-tri-n-butylstannyl thiazole,4-tri-n-butylstannyl-2-methoxy-1,3-thiazole
IUPAC Name tributyl-(2-methoxy-1,3-thiazol-4-yl)stannane
InChI Key JCZRGWAGRPABLT-UHFFFAOYSA-N
Molecular Formula C16H31NOSSn