3-({2-[(4-Cyano-phenylamino)-methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}-phenyl-amino)-propionic acid methyl ester (HCID 58069422)

基本情報

標準SMILES: COC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C#N)cc1)n2C)c1ccccc1
InChIKey: IWQJUSCTFXXCDD-UHFFFAOYSA-N
分子式: C27H25N5O3
平均分子量: 467.5 g/mol

名称と識別子

優先名称: 3-({2-[(4-Cyano-phenylamino)-methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}-phenyl-amino)-propionic acid methyl ester
IUPAC: methyl 3-(N-[2-[(4-cyanoanilino)methyl]-1-methylbenzimidazole-5-carbonyl]anilino)propanoate

名称と別名

SCHEMBL506730IWQJUSCTFXXCDD-UHFFFAOYSA-N3-({2-[(4-Cyano-phenylamino)-methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}-phenyl-amino)-propionic acid methyl ester