N-[3-[1-ethyl-7-[(2-methylpyridin-3-yl)amino]-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[3-[1-ethyl-7-[(2-methylpyridin-3-yl)amino]-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[3-[1-ethyl-7-[(2-methyl-3-pyridyl)amino]-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide CAS Name: N-[3-[1-ethyl-7-[(2-methyl-3-pyridinyl)amino]-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[3-[1-ethyl-7-[(2-methylpyridin-3-yl)amino]-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[3-[1-ethyl-2-keto-7-[(2-methyl-3-pyridyl)amino]-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide Formula: C29H26F3N7O2 MolecularWeight: 561.55765

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3)NC(=O)C4=CC(=CC=C4)C(F)(F)F)C)NC5=C(N=CC=C5)C

Isomeric SMILES

CCN1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3)NC(=O)C4=CC(=CC=C4)C(F)(F)F)C)NC5=C(N=CC=C5)C

InChI

InChI=1S/C29H26F3N7O2/c1-4-38-25-20(15-34-27(37-25)36-23-9-6-12-33-18(23)3)16-39(28(38)41)24-14-22(11-10-17(24)2)35-26(40)19-7-5-8-21(13-19)29(30,31)32/h5-15H,4,16H2,1-3H3,(H,35,40)(H,34,36,37)