4-[4-(hydroxymethyl)-6-oxidanylidene-2-[4-(trifluoromethyl)cyclohexyl]pyrimidin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(hydroxymethyl)-6-oxidanylidene-2-[4-(trifluoromethyl)cyclohexyl]pyrimidin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-(hydroxymethyl)-6-oxo-2-[4-(trifluoromethyl)cyclohexyl]pyrimidin-1-yl]benzonitrile CAS Name: 4-[4-(hydroxymethyl)-6-oxo-2-[4-(trifluoromethyl)cyclohexyl]-1-pyrimidinyl]benzonitrile IUPAC Name: 4-[4-(hydroxymethyl)-6-oxo-2-[4-(trifluoromethyl)cyclohexyl]pyrimidin-1-yl]benzonitrile Traditional Name: 4-[6-keto-4-methylol-2-[4-(trifluoromethyl)cyclohexyl]pyrimidin-1-yl]benzonitrile Formula: C19H18F3N3O2 MolecularWeight: 377.36033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=NC(=CC(=O)N2C3=CC=C(C=C3)C#N)CO)C(F)(F)F

Isomeric SMILES

C1CC(CCC1C2=NC(=CC(=O)N2C3=CC=C(C=C3)C#N)CO)C(F)(F)F

InChI

InChI=1S/C19H18F3N3O2/c20-19(21,22)14-5-3-13(4-6-14)18-24-15(11-26)9-17(27)25(18)16-7-1-12(10-23)2-8-16/h1-2,7-9,13-14,26H,3-6,11H2