7-methyl-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 7-methyl-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 7-methyl-4-oxo-2-(p-tolylsulfanyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 7-methyl-2-[(4-methylphenyl)thio]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 7-methyl-2-(4-methylphenyl)sulfanyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 4-keto-7-methyl-2-(p-tolylthio)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C17H15N2O2S+ MolecularWeight: 311.3782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)[N+]3=C(N2)C=CC(=C3)C)C=O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)[N+]3=C(N2)C=CC(=C3)C)C=O

InChI

InChI=1S/C17H14N2O2S/c1-11-3-6-13(7-4-11)22-16-14(10-20)17(21)19-9-12(2)5-8-15(19)18-16/h3-10H,1-2H3/p+1