CAS RN: 6460-73-7
CAS Name: 5-[2-[2-(5-thiazolyl)-1-benzimidazolyl]ethyl]-1,3,4-thiadiazol-2-amine
OPENEYE Name: 5-[2-(2-thiazol-5-ylbenzimidazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC Name: 5-[2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C14H12N6S2
MOLECULAR WEIGHT: 328.41528
SMILES: C1=CC=C2C(=C1)N=C(N2CCC3=NN=C(S3)N)C4=CN=CS4
Structure:
CAS RN: 6338-75-6
CAS Name: N-[4-[[(3-fluorophenyl)-oxomethyl]amino]phenyl]-2-thiophenecarboxamide
OPENEYE Name: N-[4-[(3-fluorobenzoyl)amino]phenyl]thiophene-2-carboxamide
IUPAC Name: N-[4-[(3-fluorobenzoyl)amino]phenyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[4-[(3-fluorophenyl)carbonylamino]phenyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C18H13FN2O2S
MOLECULAR WEIGHT: 340.371423
SMILES: C1=CC(=CC(=C1)F)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3
Structure:
CAS RN: 87752-94-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H16N2OS
MOLECULAR WEIGHT: 296.38674
SMILES: C1CCC2=C(CC1)SC3=C2C(=O)NC(=N3)C4=CC=CC=C4
Structure:
CAS RN: 53668-35-2
CAS Name: 4-amino-N-propan-2-ylbenzenesulfonamide
OPENEYE Name: 4-amino-N-isopropyl-benzenesulfonamide
IUPAC Name: 4-amino-N-propan-2-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-propan-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C9H14N2O2S
MOLECULAR WEIGHT: 214.28466
SMILES: CC(C)NS(=O)(=O)C1=CC=C(C=C1)N
Structure:
CAS RN: 590380-54-4
CAS Name: 4-oxo-4-(3-oxo-1-piperazinyl)butanoic acid
OPENEYE Name: 4-oxo-4-(3-oxopiperazin-1-yl)butanoic acid
IUPAC Name: 4-oxo-4-(3-oxopiperazin-1-yl)butanoic acid
SYSTEMATIC NAME: 4-oxidanylidene-4-(3-oxidanylidenepiperazin-1-yl)butanoic acid
MOLECULAR FORMULA: C8H12N2O4
MOLECULAR WEIGHT: 200.19188
SMILES: C1CN(CC(=O)N1)C(=O)CCC(=O)O
Structure:
CAS RN: 118731-67-2
CAS Name: 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol
OPENEYE Name: 2-allyl-4-(3-allyl-4-hydroxy-phenyl)sulfonyl-phenol
IUPAC Name: 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol
SYSTEMATIC NAME: 4-(4-oxidanyl-3-prop-2-enyl-phenyl)sulfonyl-2-prop-2-enyl-phenol
MOLECULAR FORMULA: C18H18O4S
MOLECULAR WEIGHT: 330.39812
SMILES: C=CCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)O)CC=C)O
Structure:
CAS RN: 41481-66-7
CAS Name: 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol
OPENEYE Name: 2-allyl-4-(3-allyl-4-hydroxy-phenyl)sulfonyl-phenol
IUPAC Name: 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol
SYSTEMATIC NAME: 4-(4-oxidanyl-3-prop-2-enyl-phenyl)sulfonyl-2-prop-2-enyl-phenol
MOLECULAR FORMULA: C18H18O4S
MOLECULAR WEIGHT: 330.39812
SMILES: C=CCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)O)CC=C)O
Structure:
CAS RN: 64691-81-2
CAS Name: 2-[(4-cyanophenyl)hydrazinylidene]propanedinitrile
OPENEYE Name: 2-[(4-cyanophenyl)hydrazono]propanedinitrile
IUPAC Name: 2-[(4-cyanophenyl)hydrazinylidene]propanedinitrile
SYSTEMATIC NAME: 2-[(4-cyanophenyl)hydrazinylidene]propanedinitrile
MOLECULAR FORMULA: C10H5N5
MOLECULAR WEIGHT: 195.1802
SMILES: C1=CC(=CC=C1C#N)NN=C(C#N)C#N
Structure:
CAS RN: 6139-12-4
CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-4-chlorobenzamide
OPENEYE Name: N-[(4-acetamidophenyl)carbamothioyl]-4-chloro-benzamide
IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-4-chlorobenzamide
SYSTEMATIC NAME: N-[(4-acetamidophenyl)carbamothioyl]-4-chloranyl-benzamide
MOLECULAR FORMULA: C16H14ClN3O2S
MOLECULAR WEIGHT: 347.81926
SMILES: CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 331-00-0
CAS Name: 1-(4-fluorophenyl)-3-(2-pyridinyl)thiourea
OPENEYE Name: 1-(4-fluorophenyl)-3-(2-pyridyl)thiourea
IUPAC Name: 1-(4-fluorophenyl)-3-pyridin-2-ylthiourea
SYSTEMATIC NAME: 1-(4-fluorophenyl)-3-pyridin-2-yl-thiourea
MOLECULAR FORMULA: C12H10FN3S
MOLECULAR WEIGHT: 247.291303
SMILES: C1=CC=NC(=C1)NC(=S)NC2=CC=C(C=C2)F
Structure:
CAS RN: 65110-21-6
CAS Name: [[4-(methylthio)phenyl]methylideneamino]thiourea
OPENEYE Name: [(4-methylsulfanylphenyl)methyleneamino]thiourea
IUPAC Name: [(4-methylsulfanylphenyl)methylideneamino]thiourea
SYSTEMATIC NAME: 1-[(4-methylsulfanylphenyl)methylideneamino]thiourea
MOLECULAR FORMULA: C9H11N3S2
MOLECULAR WEIGHT: 225.33374
SMILES: CSC1=CC=C(C=C1)C=NNC(=S)N
Structure:
CAS RN: 5801-47-8
CAS Name: 1-(4-anilinophenyl)-3-phenylthiourea
OPENEYE Name: 1-(4-anilinophenyl)-3-phenyl-thiourea
IUPAC Name: 1-(4-anilinophenyl)-3-phenylthiourea
SYSTEMATIC NAME: 1-phenyl-3-(4-phenylazanylphenyl)thiourea
MOLECULAR FORMULA: C19H17N3S
MOLECULAR WEIGHT: 319.42338
SMILES: C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3
Structure:
CAS RN: 75483-06-6
CAS Name: 2-hydroxy-N-(4-methoxyphenyl)-1-methyl-4-oxo-3-quinolinecarboxamide
OPENEYE Name: 2-hydroxy-N-(4-methoxyphenyl)-1-methyl-4-oxo-quinoline-3-carboxamide
IUPAC Name: 2-hydroxy-N-(4-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)-1-methyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide
MOLECULAR FORMULA: C18H16N2O4
MOLECULAR WEIGHT: 324.33064
SMILES: CN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)OC
Structure:
CAS RN: 6460-12-4
CAS Name: 5-methoxy-1-methyl-2-indolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 5-methoxy-1-methyl-indole-2-carboxylate
IUPAC Name: ethyl 5-methoxy-1-methylindole-2-carboxylate
SYSTEMATIC NAME: ethyl 5-methoxy-1-methyl-indole-2-carboxylate
MOLECULAR FORMULA: C13H15NO3
MOLECULAR WEIGHT: 233.2631
SMILES: CCOC(=O)C1=CC2=C(N1C)C=CC(=C2)OC
Structure:
CAS RN: 67899-00-7
CAS Name: 2-amino-4-methyl-5-thiazolecarboxylic acid
OPENEYE Name: 2-amino-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-amino-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-azanyl-4-methyl-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C5H6N2O2S
MOLECULAR WEIGHT: 158.17834
SMILES: CC1=C(SC(=N1)N)C(=O)O
Structure:
CAS RN: 5857-95-4
CAS Name: 2-(2,4-dimethylphenoxy)-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone
OPENEYE Name: 2-(2,4-dimethylphenoxy)-1-[4-(2-pyridyl)piperazin-1-yl]ethanone
IUPAC Name: 2-(2,4-dimethylphenoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
SYSTEMATIC NAME: 2-(2,4-dimethylphenoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
MOLECULAR FORMULA: C19H23N3O2
MOLECULAR WEIGHT: 325.40482
SMILES: CC1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=CC=N3)C
Structure:
CAS RN: 5246-14-0
CAS Name: N-(4-acetylphenyl)-3,4-dichlorobenzamide
OPENEYE Name: N-(4-acetylphenyl)-3,4-dichloro-benzamide
IUPAC Name: N-(4-acetylphenyl)-3,4-dichlorobenzamide
SYSTEMATIC NAME: 3,4-bis(chloranyl)-N-(4-ethanoylphenyl)benzamide
MOLECULAR FORMULA: C15H11Cl2NO2
MOLECULAR WEIGHT: 308.15934
SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)Cl
Structure:
CAS RN: 5709-85-3
CAS Name: 2-[2-(1,3-benzothiazol-2-ylamino)-4-oxo-1H-pyrimidin-6-yl]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[2-(1,3-benzothiazol-2-ylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
IUPAC Name: ethyl 2-[2-(1,3-benzothiazol-2-ylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
SYSTEMATIC NAME: ethyl 2-[2-(1,3-benzothiazol-2-ylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate
MOLECULAR FORMULA: C15H14N4O3S
MOLECULAR WEIGHT: 330.36166
SMILES: CCOC(=O)CC1=CC(=O)N=C(N1)NC2=NC3=CC=CC=C3S2
Structure:
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