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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 (2,087)
Thiazoles (1,166)
Pyrazoles (911)
Triazoles (506)
Oxazoles (309)
Isoxazoles (233)
Oxadiazoles (152)
Thiadiazoles (69)
Dithiazoles (4)

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781 – 795 of 4,203 results
781

3,5-Dimethyl-4-nitropyrazole 98.0+%, TCI America™
SDP

CAS: 14531-55-6 Molecular Formula: C5H7N3O2 Molecular Weight (g/mol): 141.13 MDL Number: MFCD00052513 InChI Key: OFQCJVVJRNPSET-UHFFFAOYSA-N PubChem CID: 146172 IUPAC Name: 3,5-dimethyl-4-nitro-1H-pyrazole SMILES: CC1=C(C(=NN1)C)[N+](=O)[O-]

PubChem CID 146172
CAS 14531-55-6
Molecular Weight (g/mol) 141.13
MDL Number MFCD00052513
SMILES CC1=C(C(=NN1)C)[N+](=O)[O-]
IUPAC Name 3,5-dimethyl-4-nitro-1H-pyrazole
InChI Key OFQCJVVJRNPSET-UHFFFAOYSA-N
Molecular Formula C5H7N3O2
782

3,5-Dimethyl-1,2,4-triazole 95.0+%, TCI America™
SDP

CAS: 7343-34-2 Molecular Formula: C4H7N3 Molecular Weight (g/mol): 97.121 MDL Number: MFCD00656686 InChI Key: XYYXDARQOHWBPO-UHFFFAOYSA-N PubChem CID: 139001 IUPAC Name: 3,5-dimethyl-1H-1,2,4-triazole SMILES: CC1=NC(=NN1)C

PubChem CID 139001
CAS 7343-34-2
Molecular Weight (g/mol) 97.121
MDL Number MFCD00656686
SMILES CC1=NC(=NN1)C
IUPAC Name 3,5-dimethyl-1H-1,2,4-triazole
InChI Key XYYXDARQOHWBPO-UHFFFAOYSA-N
Molecular Formula C4H7N3
783

4,7-Dibromo-2-(6-bromohexyl)benzotriazole 97.0+%, TCI America™
SDP

CAS: 890704-02-6 Molecular Formula: C12H14Br3N3 Molecular Weight (g/mol): 439.977 MDL Number: MFCD19440927 InChI Key: VWPRIVLLHDPAJM-UHFFFAOYSA-N PubChem CID: 71721496 IUPAC Name: 4,7-dibromo-2-(6-bromohexyl)benzotriazole SMILES: C1=C(C2=NN(N=C2C(=C1)Br)CCCCCCBr)Br

PubChem CID 71721496
CAS 890704-02-6
Molecular Weight (g/mol) 439.977
MDL Number MFCD19440927
SMILES C1=C(C2=NN(N=C2C(=C1)Br)CCCCCCBr)Br
IUPAC Name 4,7-dibromo-2-(6-bromohexyl)benzotriazole
InChI Key VWPRIVLLHDPAJM-UHFFFAOYSA-N
Molecular Formula C12H14Br3N3
784

3,5-Dimethylisoxazole-4-carbonyl Chloride 96.0+%, TCI America™
SDP

CAS: 31301-45-8 Molecular Formula: C6H6ClNO2 Molecular Weight (g/mol): 159.569 MDL Number: MFCD00052555 InChI Key: MPYGFFPGJMGVSW-UHFFFAOYSA-N Synonym: 3,5-dimethylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 3,5-dimethyl,3,5-dimethylisoxazole-4-carbonylchloride,dimethyl-1,2-oxazole-4-carbonyl chloride,3,5-dimethyl-4-isoxazolecarbonyl chloride,pubchem8669,acmc-20a3wc,3,5-dimethylisoxasole-4-carbonyl chloride,3,5-dimethyisoxazole-4-carbonyl chloride,3,5 dimethylisoxazole-4-carbonyl chloride PubChem CID: 2736265 IUPAC Name: 3,5-dimethyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C)C(=O)Cl

PubChem CID 2736265
CAS 31301-45-8
Molecular Weight (g/mol) 159.569
MDL Number MFCD00052555
SMILES CC1=C(C(=NO1)C)C(=O)Cl
Synonym 3,5-dimethylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 3,5-dimethyl,3,5-dimethylisoxazole-4-carbonylchloride,dimethyl-1,2-oxazole-4-carbonyl chloride,3,5-dimethyl-4-isoxazolecarbonyl chloride,pubchem8669,acmc-20a3wc,3,5-dimethylisoxasole-4-carbonyl chloride,3,5-dimethyisoxazole-4-carbonyl chloride,3,5 dimethylisoxazole-4-carbonyl chloride
IUPAC Name 3,5-dimethyl-1,2-oxazole-4-carbonyl chloride
InChI Key MPYGFFPGJMGVSW-UHFFFAOYSA-N
Molecular Formula C6H6ClNO2
785

4-(Chloromethyl)-3,5-dimethylisoxazole 95.0+%, TCI America™
SDP

CAS: 19788-37-5 Molecular Formula: C6H8ClNO Molecular Weight (g/mol): 145.586 MDL Number: MFCD00003154 InChI Key: NIFAUKBQIAURIM-UHFFFAOYSA-N Synonym: 4-chloromethyl-3,5-dimethylisoxazole,isoxazole, 4-chloromethyl-3,5-dimethyl,4-chloromethyl-3,5-dimethyl-1,2-oxazole,4-chloromethyl-3,5-dimethyl-isoxazole,3,5-dimethyl-4-chloromethylisoxazole,4-chloromethyl-3,5-dimethyl isoxazole,pubchem8667,acmc-1c8qy,akos bc-3064 PubChem CID: 88246 IUPAC Name: 4-(chloromethyl)-3,5-dimethyl-1,2-oxazole SMILES: CC1=C(C(=NO1)C)CCl

PubChem CID 88246
CAS 19788-37-5
Molecular Weight (g/mol) 145.586
MDL Number MFCD00003154
SMILES CC1=C(C(=NO1)C)CCl
Synonym 4-chloromethyl-3,5-dimethylisoxazole,isoxazole, 4-chloromethyl-3,5-dimethyl,4-chloromethyl-3,5-dimethyl-1,2-oxazole,4-chloromethyl-3,5-dimethyl-isoxazole,3,5-dimethyl-4-chloromethylisoxazole,4-chloromethyl-3,5-dimethyl isoxazole,pubchem8667,acmc-1c8qy,akos bc-3064
IUPAC Name 4-(chloromethyl)-3,5-dimethyl-1,2-oxazole
InChI Key NIFAUKBQIAURIM-UHFFFAOYSA-N
Molecular Formula C6H8ClNO
786

N-(Carbobenzoxy)-1H-pyrazole-1-carboxamidine 98.0+%, TCI America™
SDP

CAS: 152120-62-2 Molecular Formula: C12H12N4O2 Molecular Weight (g/mol): 244.254 MDL Number: MFCD00274657 InChI Key: BXUMISWXFKCEIA-UHFFFAOYSA-N Synonym: n-z-1h-pyrazole-1-carboxamidine,benzyl imino 1h-pyrazol-1-yl methyl carbamate,n-benzyloxycarbonyl-1h-pyrazole-1-carboxamidine,n-carbobenzoxy-1h-pyrazole-1-carboxamidine,n-z-1h-pyrazole-1-carboxamdne,benzyl n-imino 1-pyrazolyl methyl carbamate,benzyl imino-1h-pyrazol-1-yl methylcarbamate PubChem CID: 11857377 IUPAC Name: benzyl (NE)-N-[amino(pyrazol-1-yl)methylidene]carbamate SMILES: C1=CC=C(C=C1)COC(=O)N=C(N)N2C=CC=N2

PubChem CID 11857377
CAS 152120-62-2
Molecular Weight (g/mol) 244.254
MDL Number MFCD00274657
SMILES C1=CC=C(C=C1)COC(=O)N=C(N)N2C=CC=N2
Synonym n-z-1h-pyrazole-1-carboxamidine,benzyl imino 1h-pyrazol-1-yl methyl carbamate,n-benzyloxycarbonyl-1h-pyrazole-1-carboxamidine,n-carbobenzoxy-1h-pyrazole-1-carboxamidine,n-z-1h-pyrazole-1-carboxamdne,benzyl n-imino 1-pyrazolyl methyl carbamate,benzyl imino-1h-pyrazol-1-yl methylcarbamate
IUPAC Name benzyl (NE)-N-[amino(pyrazol-1-yl)methylidene]carbamate
InChI Key BXUMISWXFKCEIA-UHFFFAOYSA-N
Molecular Formula C12H12N4O2
787

Cyclic Pifithrin-alpha Hydrobromide 98.0+%, TCI America™
SDP

CAS: 511296-88-1 Molecular Formula: C16H17BrN2S Molecular Weight (g/mol): 349.29 MDL Number: MFCD02683960 InChI Key: SGNCOAOESGSEOP-UHFFFAOYSA-N Synonym: pifithrin-beta hydrobromide,cyclic-pifithrin-alpha,pifithrin-alpha, cyclic,pifithrin-alpha, cyclic,unii-up003xxt4d,2-4-methylphenyl imidazo 2,1-b-5,6,7,8-tetrahydrobenzothiazole, hbr,2-4-methylphenyl imidazo 2,1-b-5,6,7,8-tetrahydrobenzothiazole, hbr,2-4-methylphenyl imidazo 2,1-b-5,6,7,8-tetrahydrobenzothiazole hydrobromide,a hydrobromide,a hydrobromide,pifithrin-beta hydrobromide mi PubChem CID: 11515812 IUPAC Name: 4-(4-methylphenyl)-7-thia-2,5-diazatricyclo[6.4.0.0²,⁶]dodeca-1(8),3,5-triene hydrobromide SMILES: Br.CC1=CC=C(C=C1)C1=CN2C(SC3=C2CCCC3)=N1

PubChem CID 11515812
CAS 511296-88-1
Molecular Weight (g/mol) 349.29
MDL Number MFCD02683960
SMILES Br.CC1=CC=C(C=C1)C1=CN2C(SC3=C2CCCC3)=N1
Synonym pifithrin-beta hydrobromide,cyclic-pifithrin-alpha,pifithrin-alpha, cyclic,pifithrin-alpha, cyclic,unii-up003xxt4d,2-4-methylphenyl imidazo 2,1-b-5,6,7,8-tetrahydrobenzothiazole, hbr,2-4-methylphenyl imidazo 2,1-b-5,6,7,8-tetrahydrobenzothiazole, hbr,2-4-methylphenyl imidazo 2,1-b-5,6,7,8-tetrahydrobenzothiazole hydrobromide,a hydrobromide,a hydrobromide,pifithrin-beta hydrobromide mi
IUPAC Name 4-(4-methylphenyl)-7-thia-2,5-diazatricyclo[6.4.0.0²,⁶]dodeca-1(8),3,5-triene hydrobromide
InChI Key SGNCOAOESGSEOP-UHFFFAOYSA-N
Molecular Formula C16H17BrN2S
788

3-(Chloromethyl)-1,2,4-triazolin-5-one 98.0+%, TCI America™
SDP

CAS: 252742-72-6 Molecular Formula: C3H4ClN3O Molecular Weight (g/mol): 133.535 MDL Number: MFCD07776630 InChI Key: ZLRBJVJEQXBAAI-UHFFFAOYSA-N Synonym: 3-(Chloromethyl)-1H-1,2,4-triazol-5(4H)-one PubChem CID: 10129979 IUPAC Name: 5-(chloromethyl)-1,2-dihydro-1,2,4-triazol-3-one SMILES: C(C1=NC(=O)NN1)Cl

PubChem CID 10129979
CAS 252742-72-6
Molecular Weight (g/mol) 133.535
MDL Number MFCD07776630
SMILES C(C1=NC(=O)NN1)Cl
Synonym 3-(Chloromethyl)-1H-1,2,4-triazol-5(4H)-one
IUPAC Name 5-(chloromethyl)-1,2-dihydro-1,2,4-triazol-3-one
InChI Key ZLRBJVJEQXBAAI-UHFFFAOYSA-N
Molecular Formula C3H4ClN3O
789

2-(2-Chlorophenyl)-4,5-diphenylimidazole 98.0+%, TCI America™
SDP

CAS: 1707-67-1 Molecular Formula: C21H15ClN2 Molecular Weight (g/mol): 330.82 MDL Number: MFCD00030328 InChI Key: NSWNXQGJAPQOID-UHFFFAOYSA-N PubChem CID: 74356 IUPAC Name: 2-(2-chlorophenyl)-4,5-diphenyl-1H-imidazole SMILES: ClC1=CC=CC=C1C1=NC(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 74356
CAS 1707-67-1
Molecular Weight (g/mol) 330.82
MDL Number MFCD00030328
SMILES ClC1=CC=CC=C1C1=NC(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2-(2-chlorophenyl)-4,5-diphenyl-1H-imidazole
InChI Key NSWNXQGJAPQOID-UHFFFAOYSA-N
Molecular Formula C21H15ClN2
790

Flumazenil 99.0+%, TCI America™
SDP

CAS: 78755-81-4 Molecular Formula: C15H14FN3O3 Molecular Weight (g/mol): 303.293 MDL Number: MFCD00242764 InChI Key: OFBIFZUFASYYRE-UHFFFAOYSA-N Synonym: flumazenil,anexate,flumazepil,romazicon,lanexat,mazicon,flumazenilum,flumazenilo,flumazenilum latin,flumazenilo spanish PubChem CID: 3373 ChEBI: CHEBI:5103 IUPAC Name: ethyl 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate SMILES: CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)C

PubChem CID 3373
CAS 78755-81-4
Molecular Weight (g/mol) 303.293
ChEBI CHEBI:5103
MDL Number MFCD00242764
SMILES CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)C
Synonym flumazenil,anexate,flumazepil,romazicon,lanexat,mazicon,flumazenilum,flumazenilo,flumazenilum latin,flumazenilo spanish
IUPAC Name ethyl 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
InChI Key OFBIFZUFASYYRE-UHFFFAOYSA-N
Molecular Formula C15H14FN3O3
791

Famciclovir 98.0+%, TCI America™
SDP

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
792

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

CAS: 174899-82-2 Molecular Formula: C8H11F6N3O4S2 Molecular Weight (g/mol): 391.303 MDL Number: MFCD03788927 InChI Key: LRESCJAINPKJTO-UHFFFAOYSA-N PubChem CID: 11731903 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-ethyl-3-methylimidazol-3-ium SMILES: CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

PubChem CID 11731903
CAS 174899-82-2
Molecular Weight (g/mol) 391.303
MDL Number MFCD03788927
SMILES CCN1C=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-ethyl-3-methylimidazol-3-ium
InChI Key LRESCJAINPKJTO-UHFFFAOYSA-N
Molecular Formula C8H11F6N3O4S2
793

1-Ethyl-3-methylimidazolium Trifluoro(trifluoromethyl)borate 98.0+%, TCI America™
SDP

CAS: 681856-28-0 Molecular Formula: C7H11BF6N2 Molecular Weight (g/mol): 247.979 InChI Key: YTANZWHOSGQGAP-UHFFFAOYSA-N PubChem CID: 44630031 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide SMILES: [B-](C(F)(F)F)(F)(F)F.CCN1C=C[N+](=C1)C

PubChem CID 44630031
CAS 681856-28-0
Molecular Weight (g/mol) 247.979
SMILES [B-](C(F)(F)F)(F)(F)F.CCN1C=C[N+](=C1)C
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide
InChI Key YTANZWHOSGQGAP-UHFFFAOYSA-N
Molecular Formula C7H11BF6N2
794

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

CAS: 65039-08-9 Molecular Formula: C6H11BrN2 Molecular Weight (g/mol): 191.07 MDL Number: MFCD03427610 InChI Key: GWQYPLXGJIXMMV-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br PubChem CID: 2734235 IUPAC Name: 1-ethyl-3-methyl-1H-imidazol-3-ium bromide SMILES: [Br-].CCN1C=C[N+](C)=C1

PubChem CID 2734235
CAS 65039-08-9
Molecular Weight (g/mol) 191.07
MDL Number MFCD03427610
SMILES [Br-].CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br
IUPAC Name 1-ethyl-3-methyl-1H-imidazol-3-ium bromide
InChI Key GWQYPLXGJIXMMV-UHFFFAOYSA-M
Molecular Formula C6H11BrN2
795

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

CAS: 145022-45-3 Molecular Formula: C7H14N2O3S Molecular Weight (g/mol): 206.26 MDL Number: MFCD06798171 InChI Key: IXLWEDFOKSJYBD-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium methanesulfonate,1-ethyl-3-methylimidazolium mesylate,basionics'st 35,basionics™ st 35,acmc-1c0dz,dsstox_cid_29075,dsstox_rid_83294,dsstox_gsid_49219,1-ethyl-3-methyl imidazolium methyl sulfonate,1-ethyl-3-methylimidazolium me-thanesulfonate PubChem CID: 16211849 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;methanesulfonate SMILES: CCN1C=C[N+](=C1)C.CS(=O)(=O)[O-]

PubChem CID 16211849
CAS 145022-45-3
Molecular Weight (g/mol) 206.26
MDL Number MFCD06798171
SMILES CCN1C=C[N+](=C1)C.CS(=O)(=O)[O-]
Synonym 1-ethyl-3-methylimidazolium methanesulfonate,1-ethyl-3-methylimidazolium mesylate,basionics'st 35,basionics™ st 35,acmc-1c0dz,dsstox_cid_29075,dsstox_rid_83294,dsstox_gsid_49219,1-ethyl-3-methyl imidazolium methyl sulfonate,1-ethyl-3-methylimidazolium me-thanesulfonate
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;methanesulfonate
InChI Key IXLWEDFOKSJYBD-UHFFFAOYSA-M
Molecular Formula C7H14N2O3S