6-methyl-2-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-methyl-2-[(6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-methyl-2-[(6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(4-keto-6-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-6-methyl-4-(trifluoromethyl)nicotinonitrile Formula: C18H13F3N4OS MolecularWeight: 390.38223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)CSC3=C(C(=CC(=N3)C)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)CSC3=C(C(=CC(=N3)C)C(F)(F)F)C#N

InChI

InChI=1S/C18H13F3N4OS/c1-10-6-14(18(19,20)21)13(8-22)17(23-10)27-9-12-7-16(26)25-11(2)4-3-5-15(25)24-12/h3-7H,9H2,1-2H3