HIT ID: HIT100386976

Cas No: 1164478-67-4

分子式: C24H17ClN2O6

分子量: 464.86

常用名: 2-(4-nitrophenyl)-2-oxoethyl (2Z)-3-(4-chlorophenyl)-2-(phenylformamido)prop-2-enoate, SARS-CoV-2 3CLpro-IN-7

氢键受体数 (HBA): 11

氢键供体数 (HBD): 1

LogP: 4.5524

IUPAC: 2-(4-nitrophenyl)-2-oxoethyl (2Z)-3-(4-chlorophenyl)-2-(phenylformamido)prop-2-enoate

SMILES: [O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Cl)cc1

InChI key: BFCXRRSXOTYUIA-STZFKDTASA-N