Antitumor agent-55
HIT214433013
sdf文件结构编辑类似物检索
HIT ID: HIT214433013
Cas No: 2522594-49-4
分子式: C32H34N6O4S
分子量: 598.72
常用名: Antitumor agent-55
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3,4,5-trimethoxy-N-[1-(5-methyl-2-{[(naphthalen-1-yl)methyl]sulfanyl}-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-3-yl]benzamide
IUPAC: 3,4,5-trimethoxy-N-[1-(5-methyl-2-{[(naphthalen-1-yl)methyl]sulfanyl}-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-3-yl]benzamide
SMILES: COc1cc(cc(OC)c1OC)C(=O)NC1CCCN(C1)c1cc(C)nc2nc(SCc3cccc4ccccc34)nn12
SMILES: COc1cc(cc(OC)c1OC)C(=O)NC1CCCN(C1)c1cc(C)nc2nc(SCc3cccc4ccccc34)nn12
InChI key: QDVCZPRTGHJWFT-UHFFFAOYSA-N
共显示1个结果
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