HIT ID: HIT100386976
Cas No: 1164478-67-4
分子式: C24H17ClN2O6
分子量: 464.86
常用名: 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
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
SMILES: [O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Cl)cc1
InChI key: BFCXRRSXOTYUIA-STZFKDTASA-N
