Edoxaban hydrochloride
HIT214432873
sdf文件结构编辑类似物检索
HIT ID: HIT214432873
Cas No: 480448-29-1
分子式: C24H31Cl2N7O4S
分子量: 584.52
常用名: Edoxaban hydrochloride
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N'-(5-chloropyridin-2-yl)-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-{5-methyl-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine-2-amido}cyclohexyl]ethanediamide hydrochloride
IUPAC: N'-(5-chloropyridin-2-yl)-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-{5-methyl-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine-2-amido}cyclohexyl]ethanediamide hydrochloride
SMILES: Cl.CN(C)C(=O)[C@H]1CC[C@H](NC(=O)C(=O)Nc2ccc(Cl)cn2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
SMILES: Cl.CN(C)C(=O)[C@H]1CC[C@H](NC(=O)C(=O)Nc2ccc(Cl)cn2)[C@@H](C1)NC(=O)c1nc2CCN(C)Cc2s1
InChI key: ZQYCNCZOSSOOQR-QXXZOGQOSA-N
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