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Azoles

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361 – 375 of 6,113 results
361

Astemizole, 99+%

CAS: 68844-77-9 Molecular Formula: C28H31FN4O Molecular Weight (g/mol): 458.581 MDL Number: MFCD00153919 InChI Key: GXDALQBWZGODGZ-UHFFFAOYSA-N Synonym: astemizole,hismanal,histaminos,paralergin,laridal,retolen,alermizol,astemison,astemizol,histamen PubChem CID: 2247 ChEBI: CHEBI:2896 IUPAC Name: 1-[(4-fluorophenyl)methyl]-N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]benzimidazol-2-amine SMILES: COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F

PubChem CID 2247
CAS 68844-77-9
Molecular Weight (g/mol) 458.581
ChEBI CHEBI:2896
MDL Number MFCD00153919
SMILES COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F
Synonym astemizole,hismanal,histaminos,paralergin,laridal,retolen,alermizol,astemison,astemizol,histamen
IUPAC Name 1-[(4-fluorophenyl)methyl]-N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]benzimidazol-2-amine
InChI Key GXDALQBWZGODGZ-UHFFFAOYSA-N
Molecular Formula C28H31FN4O
362

1-Allylimidazole, 97%

CAS: 31410-01-2 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.14 MDL Number: MFCD00037894 InChI Key: XLXCHZCQTCBUOX-UHFFFAOYSA-N Synonym: 1-allylimidazole,1-allyl-1h-imidazole,1-prop-2-en-1-yl-1h-imidazole,1h-imidazole, 1-2-propenyl,1-prop-2-en-1-yl imidazole,imidazole, 1-allyl,n-allylimidazole,1-allyl imidazole,acmc-1cr2q,1-allyl-1h-imidazole # PubChem CID: 35794 IUPAC Name: 1-prop-2-enylimidazole SMILES: C=CCN1C=CN=C1

PubChem CID 35794
CAS 31410-01-2
Molecular Weight (g/mol) 108.14
MDL Number MFCD00037894
SMILES C=CCN1C=CN=C1
Synonym 1-allylimidazole,1-allyl-1h-imidazole,1-prop-2-en-1-yl-1h-imidazole,1h-imidazole, 1-2-propenyl,1-prop-2-en-1-yl imidazole,imidazole, 1-allyl,n-allylimidazole,1-allyl imidazole,acmc-1cr2q,1-allyl-1h-imidazole #
IUPAC Name 1-prop-2-enylimidazole
InChI Key XLXCHZCQTCBUOX-UHFFFAOYSA-N
Molecular Formula C6H8N2
363

Ethyl 5-amino-3-methylisothiazole-4-carboxylate, 97%, Thermo Scientific™

CAS: 34859-65-9 Molecular Formula: C7H10N2O2S Molecular Weight (g/mol): 186.229 InChI Key: ZDGBWOZFPKNORL-UHFFFAOYSA-N PubChem CID: 2820511 IUPAC Name: ethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate SMILES: CCOC(=O)C1=C(SN=C1C)N

PubChem CID 2820511
CAS 34859-65-9
Molecular Weight (g/mol) 186.229
SMILES CCOC(=O)C1=C(SN=C1C)N
IUPAC Name ethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate
InChI Key ZDGBWOZFPKNORL-UHFFFAOYSA-N
Molecular Formula C7H10N2O2S
364

Thermo Scientific Chemicals Myclobutanil

CAS: 88671-89-0 Molecular Formula: C15H17ClN4 Molecular Weight (g/mol): 288.78 InChI Key: HZJKXKUJVSEEFU-UHFFFAOYNA-N IUPAC Name: 2-(4-chlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]hexanenitrile SMILES: CCCCC(CN1C=NC=N1)(C#N)C1=CC=C(Cl)C=C1

CAS 88671-89-0
Molecular Weight (g/mol) 288.78
SMILES CCCCC(CN1C=NC=N1)(C#N)C1=CC=C(Cl)C=C1
IUPAC Name 2-(4-chlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]hexanenitrile
InChI Key HZJKXKUJVSEEFU-UHFFFAOYNA-N
Molecular Formula C15H17ClN4
365

2-Bromo-4-methyl-1,3-thiazole-5-carboxylic acid, 95%, Thermo Scientific™

CAS: 40003-41-6 Molecular Formula: C5H4BrNO2S Molecular Weight (g/mol): 222.056 MDL Number: MFCD03822128 InChI Key: HMSQZHBSTZZNGI-UHFFFAOYSA-N Synonym: 2-bromo-4-methylthiazole-5-carboxylic acid,2-bromo-4-methyl-thiazole-5-carboxylic acid,2-bromo-4-methylthiazol-5-carboxylic acid,5-thiazolecarboxylic acid, 2-bromo-4-methyl,maybridge3_004237,pubchem23205,acmc-209x4s,2-bromo-4-methyl-5-thiazolecarboxylic acid,2-bromo-4-methyl-5-thiazole carboxylic acid PubChem CID: 2824058 IUPAC Name: 2-bromo-4-methyl-1,3-thiazole-5-carboxylic acid SMILES: CC1=C(SC(=N1)Br)C(=O)O

PubChem CID 2824058
CAS 40003-41-6
Molecular Weight (g/mol) 222.056
MDL Number MFCD03822128
SMILES CC1=C(SC(=N1)Br)C(=O)O
Synonym 2-bromo-4-methylthiazole-5-carboxylic acid,2-bromo-4-methyl-thiazole-5-carboxylic acid,2-bromo-4-methylthiazol-5-carboxylic acid,5-thiazolecarboxylic acid, 2-bromo-4-methyl,maybridge3_004237,pubchem23205,acmc-209x4s,2-bromo-4-methyl-5-thiazolecarboxylic acid,2-bromo-4-methyl-5-thiazole carboxylic acid
IUPAC Name 2-bromo-4-methyl-1,3-thiazole-5-carboxylic acid
InChI Key HMSQZHBSTZZNGI-UHFFFAOYSA-N
Molecular Formula C5H4BrNO2S
366

Methyl 1-methyl-1H-imidazole-4-carboxylate, 97%, Thermo Scientific™

CAS: 17289-19-9 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD02179561 InChI Key: KZPZTVKOJSKVBV-UHFFFAOYSA-N Synonym: methyl 1-methyl-1h-imidazole-4-carboxylate,1-methyl-1h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-4-carboxylic acid, 1-methyl-, methyl ester,pubchem9002,acmc-209e5g,methyl1-methyl-1h-imidazole-4-carboxylate,ksc534i0d,methyl 1-methylimidazol-4-carboxylate,methyl 1-methyl-1h-imidazole-carboxylate,4-methoxycarbonyl-1-methyl-1h-imidazole PubChem CID: 2773510 IUPAC Name: methyl 1-methylimidazole-4-carboxylate SMILES: CN1C=C(N=C1)C(=O)OC

PubChem CID 2773510
CAS 17289-19-9
Molecular Weight (g/mol) 140.142
MDL Number MFCD02179561
SMILES CN1C=C(N=C1)C(=O)OC
Synonym methyl 1-methyl-1h-imidazole-4-carboxylate,1-methyl-1h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-4-carboxylic acid, 1-methyl-, methyl ester,pubchem9002,acmc-209e5g,methyl1-methyl-1h-imidazole-4-carboxylate,ksc534i0d,methyl 1-methylimidazol-4-carboxylate,methyl 1-methyl-1h-imidazole-carboxylate,4-methoxycarbonyl-1-methyl-1h-imidazole
IUPAC Name methyl 1-methylimidazole-4-carboxylate
InChI Key KZPZTVKOJSKVBV-UHFFFAOYSA-N
Molecular Formula C6H8N2O2
367

5-Methyl-3-phenylisoxazole-4-carbonyl chloride, 90%, Thermo Scientific™

CAS: 16883-16-2 Molecular Formula: C11H8ClNO2 Molecular Weight (g/mol): 221.64 MDL Number: MFCD00052205 InChI Key: HXEVQMXCHCDPSO-UHFFFAOYSA-N Synonym: 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452 PubChem CID: 85624 IUPAC Name: 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl

PubChem CID 85624
CAS 16883-16-2
Molecular Weight (g/mol) 221.64
MDL Number MFCD00052205
SMILES CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl
Synonym 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452
IUPAC Name 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride
InChI Key HXEVQMXCHCDPSO-UHFFFAOYSA-N
Molecular Formula C11H8ClNO2
368

1-Chloromethyl-1H-1,2,4-triazole, hydrochloride, 98%, Thermo Scientific™

CAS: 84387-61-1 Molecular Formula: C3H5Cl2N3 Molecular Weight (g/mol): 153.99 MDL Number: MFCD00964947 InChI Key: GXVWDLWTFIDZLR-UHFFFAOYSA-N Synonym: 1-chloromethyl-1h-1,2,4-triazole hydrochloride,1-chloromethyl-1,2,4-triazole hydrochloride,1h-1,2,4-triazole,1-chloromethyl-,monohydrochloride,1h-1,2,4-triazole, 1-chloromethyl-, monohydrochloride PubChem CID: 13268168 IUPAC Name: 1-(chloromethyl)-1,2,4-triazole;hydrochloride SMILES: Cl.ClCN1C=NC=N1

PubChem CID 13268168
CAS 84387-61-1
Molecular Weight (g/mol) 153.99
MDL Number MFCD00964947
SMILES Cl.ClCN1C=NC=N1
Synonym 1-chloromethyl-1h-1,2,4-triazole hydrochloride,1-chloromethyl-1,2,4-triazole hydrochloride,1h-1,2,4-triazole,1-chloromethyl-,monohydrochloride,1h-1,2,4-triazole, 1-chloromethyl-, monohydrochloride
IUPAC Name 1-(chloromethyl)-1,2,4-triazole;hydrochloride
InChI Key GXVWDLWTFIDZLR-UHFFFAOYSA-N
Molecular Formula C3H5Cl2N3
369

3-Amino-4-iodo-1H-indazole, 95%, Thermo Scientific™

CAS: 599191-73-8 Molecular Formula: C7H6IN3 Molecular Weight (g/mol): 259.05 MDL Number: MFCD03426697 InChI Key: OEQIVIYSUJXCFG-UHFFFAOYSA-N Synonym: 4-iodo-1h-indazol-3-ylamine,3-amino-4-iodo-1h-indazole,1h-indazol-3-amine, 4-iodo,3-amino-4-iodoindazole,4-iodo-1h-indazol-amine,ksc268o0n,4-iodo-1h-indazole-3-amine,4-iodo-1h-indazole-3-ylamine,3-amino-4-iodo-indazole PubChem CID: 4057787 IUPAC Name: 4-iodo-1H-indazol-3-amine SMILES: NC1=NNC2=CC=CC(I)=C12

PubChem CID 4057787
CAS 599191-73-8
Molecular Weight (g/mol) 259.05
MDL Number MFCD03426697
SMILES NC1=NNC2=CC=CC(I)=C12
Synonym 4-iodo-1h-indazol-3-ylamine,3-amino-4-iodo-1h-indazole,1h-indazol-3-amine, 4-iodo,3-amino-4-iodoindazole,4-iodo-1h-indazol-amine,ksc268o0n,4-iodo-1h-indazole-3-amine,4-iodo-1h-indazole-3-ylamine,3-amino-4-iodo-indazole
IUPAC Name 4-iodo-1H-indazol-3-amine
InChI Key OEQIVIYSUJXCFG-UHFFFAOYSA-N
Molecular Formula C7H6IN3
370

1,3-Dimesitylimidazolium chloride, 95%

CAS: 141556-45-8 Molecular Formula: C21H25ClN2 Molecular Weight (g/mol): 340.90 MDL Number: MFCD02684541 InChI Key: OTOSIXGMLYKKOW-UHFFFAOYSA-M Synonym: 1,3-bis 2,4,6-trimethylphenyl imidazolium chloride,1,3-dimesityl-1h-imidazol-3-ium chloride,1,3-dimesitylimidazolium chloride,1,3-bis mesityl imidazolium chloride,imes.hcl,1,3-bis 2,4,6-trimethylphenyl imidazoliumchloride,1,3-2,4,6-trimethylphenyl imidazolium chloride,1,3-bis-2,4,6-trimethylphenyl-1h-imidazolium chloride,1,3-bis-2,4,6-trimethyl-phenyl-3h-imidazol-1-ium chloride,1,3-dihydro-1,3-dimesityl-2h-imidazol-2-ylidene monohydrochloride PubChem CID: 2734211 IUPAC Name: 1,3-bis(2,4,6-trimethylphenyl)imidazol-1-ium;chloride SMILES: [Cl-].CC1=CC(C)=C(N2C=C[N+](=C2)C2=C(C)C=C(C)C=C2C)C(C)=C1

PubChem CID 2734211
CAS 141556-45-8
Molecular Weight (g/mol) 340.90
MDL Number MFCD02684541
SMILES [Cl-].CC1=CC(C)=C(N2C=C[N+](=C2)C2=C(C)C=C(C)C=C2C)C(C)=C1
Synonym 1,3-bis 2,4,6-trimethylphenyl imidazolium chloride,1,3-dimesityl-1h-imidazol-3-ium chloride,1,3-dimesitylimidazolium chloride,1,3-bis mesityl imidazolium chloride,imes.hcl,1,3-bis 2,4,6-trimethylphenyl imidazoliumchloride,1,3-2,4,6-trimethylphenyl imidazolium chloride,1,3-bis-2,4,6-trimethylphenyl-1h-imidazolium chloride,1,3-bis-2,4,6-trimethyl-phenyl-3h-imidazol-1-ium chloride,1,3-dihydro-1,3-dimesityl-2h-imidazol-2-ylidene monohydrochloride
IUPAC Name 1,3-bis(2,4,6-trimethylphenyl)imidazol-1-ium;chloride
InChI Key OTOSIXGMLYKKOW-UHFFFAOYSA-M
Molecular Formula C21H25ClN2
371

Benzotriazole, Spectrum™ Chemical
SDP

CAS: 95-14-7

CAS 95-14-7
372

3-Cyclopropyl-1-methyl-1H-pyrazol-5-amine, 97%, Thermo Scientific™

CAS: 118430-74-3 Molecular Formula: C7H11N3 Molecular Weight (g/mol): 137.19 MDL Number: MFCD00067984 InChI Key: YWHWPIRLFHZSFS-UHFFFAOYSA-N PubChem CID: 2735311 SMILES: CN1N=C(C=C1N)C1CC1

PubChem CID 2735311
CAS 118430-74-3
Molecular Weight (g/mol) 137.19
MDL Number MFCD00067984
SMILES CN1N=C(C=C1N)C1CC1
InChI Key YWHWPIRLFHZSFS-UHFFFAOYSA-N
Molecular Formula C7H11N3
373

Nalidixic acid sodium salt

CAS: 5-8-3374 Molecular Formula: C12H11N2NaO3 Molecular Weight (g/mol): 254.22 InChI Key: ROKRAUFZFDQWLE-UHFFFAOYSA-M IUPAC Name: sodium 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate SMILES: [Na+].CCN1C=C(C([O-])=O)C(=O)C2=CC=C(C)N=C12

CAS 5-8-3374
Molecular Weight (g/mol) 254.22
SMILES [Na+].CCN1C=C(C([O-])=O)C(=O)C2=CC=C(C)N=C12
IUPAC Name sodium 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
InChI Key ROKRAUFZFDQWLE-UHFFFAOYSA-M
Molecular Formula C12H11N2NaO3
374

Methyle1-methyl-1H-imidazole-5-carboxylate, 97%, Thermo Scientific™

CAS: 17289-20-2 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.14 MDL Number: MFCD01567300 InChI Key: AKDPLDCXQNEMCL-UHFFFAOYSA-N Synonym: methyl 1-methyl-1h-imidazole-5-carboxylate,methyl 1-methylimidazole-5-carboxylate,methyl1-methyl-1h-imidazole-5-carboxylate,3-methyl-3h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-5-carboxylic acid, 1-methyl-, methyl ester,1-methyl-1h-imidazole-5-carboxylic acid methyl ester,pubchem9004,acmc-209e5h,1-methylimidazole-5-carboxylic acid methyl ester,1h-imidazole-5-carboxylicacid, 1-methyl-, methyl ester PubChem CID: 2736896 IUPAC Name: methyl 3-methylimidazole-4-carboxylate SMILES: COC(=O)C1=CN=CN1C

PubChem CID 2736896
CAS 17289-20-2
Molecular Weight (g/mol) 140.14
MDL Number MFCD01567300
SMILES COC(=O)C1=CN=CN1C
Synonym methyl 1-methyl-1h-imidazole-5-carboxylate,methyl 1-methylimidazole-5-carboxylate,methyl1-methyl-1h-imidazole-5-carboxylate,3-methyl-3h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-5-carboxylic acid, 1-methyl-, methyl ester,1-methyl-1h-imidazole-5-carboxylic acid methyl ester,pubchem9004,acmc-209e5h,1-methylimidazole-5-carboxylic acid methyl ester,1h-imidazole-5-carboxylicacid, 1-methyl-, methyl ester
IUPAC Name methyl 3-methylimidazole-4-carboxylate
InChI Key AKDPLDCXQNEMCL-UHFFFAOYSA-N
Molecular Formula C6H8N2O2
375

1H-Indazole, 99%

CAS: 271-44-3 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00005691 InChI Key: BAXOFTOLAUCFNW-UHFFFAOYSA-N Synonym: indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole PubChem CID: 9221 ChEBI: CHEBI:36669 IUPAC Name: 1H-indazole SMILES: C1=CC=C2C(=C1)C=NN2

PubChem CID 9221
CAS 271-44-3
Molecular Weight (g/mol) 118.139
ChEBI CHEBI:36669
MDL Number MFCD00005691
SMILES C1=CC=C2C(=C1)C=NN2
Synonym indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole
IUPAC Name 1H-indazole
InChI Key BAXOFTOLAUCFNW-UHFFFAOYSA-N
Molecular Formula C7H6N2