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

Systemtic Name: 5-(2-methylsulfanylpyrimidin-4-yl)-2-oxidanylidene-6-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carbonitrile Openeye Name: 5-(2-methylsulfanylpyrimidin-4-yl)-2-oxo-6-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carbonitrile CAS Name: 5-[2-(methylthio)-4-pyrimidinyl]-2-oxo-6-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carbonitrile IUPAC Name: 5-(2-methylsulfanylpyrimidin-4-yl)-2-oxo-6-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carbonitrile Traditional Name: 2-keto-5-[2-(methylthio)pyrimidin-4-yl]-6-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carbonitrile Formula: C18H11F3N4OS MolecularWeight: 388.36635

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=C(NC(=O)C(=C2)C#N)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CSC1=NC=CC(=N1)C2=C(NC(=O)C(=C2)C#N)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H11F3N4OS/c1-27-17-23-6-5-14(24-17)13-8-11(9-22)16(26)25-15(13)10-3-2-4-12(7-10)18(19,20)21/h2-8H,1H3,(H,25,26)