CFT1946
HIT217584960
sdf文件结构编辑类似物检索
HIT ID: HIT217584960
Cas No: 2882165-79-7
分子式: C45H49F2N11O9S
分子量: 958.01
常用名: CFT1946
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-({3-[(3R)-8-(2-{1-[3-(2,4-dioxo-1,3-diazinan-1-yl)-5-fluoro-1-methyl-1H-indazol-6-yl]-4-hydroxypiperidin-4-yl}acetyl)-1-oxa-8-azaspiro[4.5]decan-3-yl]-4-oxo-3,4-dihydroquinazolin-6-yl}oxy)-6-{[ethyl(methyl)sulfamoyl]amino}-3-fluorobenzonitrile
IUPAC: 2-({3-[(3R)-8-(2-{1-[3-(2,4-dioxo-1,3-diazinan-1-yl)-5-fluoro-1-methyl-1H-indazol-6-yl]-4-hydroxypiperidin-4-yl}acetyl)-1-oxa-8-azaspiro[4.5]decan-3-yl]-4-oxo-3,4-dihydroquinazolin-6-yl}oxy)-6-{[ethyl(methyl)sulfamoyl]amino}-3-fluorobenzonitrile
SMILES: CCN(C)S(=O)(=O)Nc1ccc(F)c(Oc2ccc3ncn([C@H]4COC5(C4)CCN(CC5)C(=O)CC4(O)CCN(CC4)c4cc5n(C)nc(N6CCC(=O)NC6=O)c5cc4F)c(=O)c3c2)c1C#N
SMILES: CCN(C)S(=O)(=O)Nc1ccc(F)c(Oc2ccc3ncn([C@H]4COC5(C4)CCN(CC5)C(=O)CC4(O)CCN(CC4)c4cc5n(C)nc(N6CCC(=O)NC6=O)c5cc4F)c(=O)c3c2)c1C#N
InChI key: OCDRMYDQTIPVOI-HHHXNRCGSA-N
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