HIT ID: HIT218850583
Cas No: 1776948-12-9
分子式: C27H34N2OS2
分子量: 466.7
常用名: hBChE-IN-1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 1-{[3-({[(1R,9aR)-octahydro-1H-quinolizin-1-yl]methyl}sulfanyl)propyl]amino}-4-methyl-9H-thioxanthen-9-one
IUPAC: 1-{[3-({[(1R,9aR)-octahydro-1H-quinolizin-1-yl]methyl}sulfanyl)propyl]amino}-4-methyl-9H-thioxanthen-9-one
SMILES: [H][C@]12CCCCN1CCC[C@H]2CSCCCNc1ccc(C)c2sc3ccccc3c(=O)c12
SMILES: [H][C@]12CCCCN1CCC[C@H]2CSCCCNc1ccc(C)c2sc3ccccc3c(=O)c12
InChI key: RTSVPQGEMHVGDV-NZQKXSOJSA-N