Neceprevir
HIT214319974
sdf文件结构编辑类似物检索
HIT ID: HIT214319974
Cas No: 1229626-28-1
分子式: C45H56F2N6O8S2
分子量: 911.09
常用名: Neceprevir
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1S,4R,6S,7E,14R,18R)-N-(cyclopropanesulfonyl)-14-[2-(3,3-difluoropiperidin-1-yl)-2-oxoethyl]-18-({7-methoxy-8-methyl-2-[4-(propan-2-yl)-1,3-thiazol-2-yl]quinolin-4-yl}oxy)-2,15-dioxo-3,16-diazatricyclo[14.3.0.0^{4,6}]nonadec-7-ene-4-carboxamide
IUPAC: (1S,4R,6S,7E,14R,18R)-N-(cyclopropanesulfonyl)-14-[2-(3,3-difluoropiperidin-1-yl)-2-oxoethyl]-18-({7-methoxy-8-methyl-2-[4-(propan-2-yl)-1,3-thiazol-2-yl]quinolin-4-yl}oxy)-2,15-dioxo-3,16-diazatricyclo[14.3.0.0^{4,6}]nonadec-7-ene-4-carboxamide
SMILES: [H][C@@]12C[C@]1(NC(=O)[C@]1([H])C[C@H](CN1C(=O)[C@@H](CC(=O)N1CCCC(F)(F)C1)CCCCC\C=C\2)Oc1cc(nc2c(C)c(OC)ccc12)-c1nc(cs1)C(C)C)C(=O)NS(=O)(=O)C1CC1 |t:35|
SMILES: [H][C@@]12C[C@]1(NC(=O)[C@]1([H])C[C@H](CN1C(=O)[C@@H](CC(=O)N1CCCC(F)(F)C1)CCCCC\C=C\2)Oc1cc(nc2c(C)c(OC)ccc12)-c1nc(cs1)C(C)C)C(=O)NS(=O)(=O)C1CC1 |t:35|
InChI key: UDMJANYPQWEDFT-FCVZZWOFSA-N
共显示1个结果
供应商规格单价货期纯度操作
TargetMol
SC
10600 购物车
TargetMol | Target Loading
正在加载 ~