HIT ID: HIT212669370
Cas No: 402567-16-2;477775-14-7
分子式: C23H29N3O4S2
分子量: 475.62
常用名: Buloxibutid
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 4.496548
IUPAC: butyl N-[(3-{4-[(1H-imidazol-1-yl)methyl]phenyl}-5-(2-methylpropyl)thiophen-2-yl)sulfonyl]carbamate
IUPAC: butyl N-[(3-{4-[(1H-imidazol-1-yl)methyl]phenyl}-5-(2-methylpropyl)thiophen-2-yl)sulfonyl]carbamate
SMILES: CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1
SMILES: CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1
InChI key: XTEOJPUYZWEXFI-UHFFFAOYSA-N