SIJ1777
HIT218903865
sdf文件结构编辑类似物检索
HIT ID: HIT218903865
Cas No: 839707-55-0
分子式: C26H23F3N8O2
分子量: 536.519
常用名: SIJ1777
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-(4-methyl-3-{1-methyl-7-[(1-methyl-1H-pyrazol-3-yl)amino]-2-oxo-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidin-3-yl}phenyl)-3-(trifluoromethyl)benzamide
IUPAC: N-(4-methyl-3-{1-methyl-7-[(1-methyl-1H-pyrazol-3-yl)amino]-2-oxo-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidin-3-yl}phenyl)-3-(trifluoromethyl)benzamide
SMILES: CN1C(=O)N(Cc2cnc(Nc3ccn(C)n3)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
SMILES: CN1C(=O)N(Cc2cnc(Nc3ccn(C)n3)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
InChI key: YTEVPQFZEINXLD-UHFFFAOYSA-N
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