HIT ID: HIT215291004
Cas No: 133276-52-5
分子式: C25H25ClN2O4S
分子量: 485
常用名: (Iso)-Samixogrel
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6-{4-[2-(4-chlorobenzenesulfonamido)ethyl]phenyl}-6-(pyridin-3-yl)hex-5-enoic acid
IUPAC: 6-{4-[2-(4-chlorobenzenesulfonamido)ethyl]phenyl}-6-(pyridin-3-yl)hex-5-enoic acid
SMILES: OC(=O)CCCC=C(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1
SMILES: OC(=O)CCCC=C(c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)c1cccnc1
InChI key: LGHLGTHRJNIRCA-UHFFFAOYSA-N
