O-Demethyl Apremilast
HIT214320869
sdf文件结构编辑类似物检索
HIT ID: HIT214320869
Cas No: 1384441-38-6
分子式: C21H22N2O7S
分子量: 446.47
常用名: O-Demethyl Apremilast
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-{2-[(1S)-1-(3-ethoxy-4-hydroxyphenyl)-2-methanesulfonylethyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl}acetamide
IUPAC: N-{2-[(1S)-1-(3-ethoxy-4-hydroxyphenyl)-2-methanesulfonylethyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl}acetamide
SMILES: CCOc1cc(ccc1O)[C@@H](CS(C)(=O)=O)N1C(=O)c2cccc(NC(C)=O)c2C1=O
SMILES: CCOc1cc(ccc1O)[C@@H](CS(C)(=O)=O)N1C(=O)c2cccc(NC(C)=O)c2C1=O
InChI key: PEUJABWEZWJNBO-MRXNPFEDSA-N
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