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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1C2=NC(=NC=C2)NC(C)C3=CC=CC=C3)C4=CC(=CC=C4)C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1C2=NC(=NC=C2)NC(C)C3=CC=CC=C3)C4=CC(=CC=C4)C(F)(F)F)C#N

InChI

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