1-methyl-2-oxidanylidene-5-[2-(1-phenylethylamino)pyrimidin-4-yl]-6-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

Systemtic Name: 1-methyl-2-oxidanylidene-5-[2-(1-phenylethylamino)pyrimidin-4-yl]-6-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile Openeye Name: 1-methyl-2-oxo-5-[2-(1-phenylethylamino)pyrimidin-4-yl]-6-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile CAS Name: 1-methyl-2-oxo-5-[2-(1-phenylethylamino)-4-pyrimidinyl]-6-[3-(trifluoromethyl)phenyl]-3-pyridinecarbonitrile IUPAC Name: 1-methyl-2-oxo-5-[2-(1-phenylethylamino)pyrimidin-4-yl]-6-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile Traditional Name: 2-keto-1-methyl-5-[2-(1-phenylethylamino)pyrimidin-4-yl]-6-[3-(trifluoromethyl)phenyl]nicotinonitrile Formula: C26H20F3N5O MolecularWeight: 475.46511

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=C(N(C(=O)C(=C3)C#N)C)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=C(N(C(=O)C(=C3)C#N)C)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C26H20F3N5O/c1-16(17-7-4-3-5-8-17)32-25-31-12-11-22(33-25)21-14-19(15-30)24(35)34(2)23(21)18-9-6-10-20(13-18)26(27,28)29/h3-14,16H,1-2H3,(H,31,32,33)