9-methyl-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carbonitrile

Systemtic Name: 9-methyl-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carbonitrile Openeye Name: 9-methyl-4-oxo-2-(p-tolylsulfanyl)pyrido[1,2-a]pyrimidine-3-carbonitrile CAS Name: 9-methyl-2-[(4-methylphenyl)thio]-4-oxo-3-pyrido[1,2-a]pyrimidinecarbonitrile IUPAC Name: 9-methyl-2-(4-methylphenyl)sulfanyl-4-oxopyrido[1,2-a]pyrimidine-3-carbonitrile Traditional Name: 4-keto-9-methyl-2-(p-tolylthio)pyrido[1,2-a]pyrimidine-3-carbonitrile Formula: C17H13N3OS MolecularWeight: 307.36962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N3C=CC=C(C3=N2)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N3C=CC=C(C3=N2)C)C#N

InChI

InChI=1S/C17H13N3OS/c1-11-5-7-13(8-6-11)22-16-14(10-18)17(21)20-9-3-4-12(2)15(20)19-16/h3-9H,1-2H3