9-methyl-3-(phenylazanylmethylidene)-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 9-methyl-3-(phenylazanylmethylidene)-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-(anilinomethylene)-2-benzylsulfanyl-9-methyl-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-(anilinomethylidene)-9-methyl-2-(phenylmethylthio)-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 3-(anilinomethylidene)-2-benzylsulfanyl-9-methylpyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-(anilinomethylene)-2-(benzylthio)-9-methyl-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C23H20N3OS+ MolecularWeight: 386.4894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2N=C(C(=CNC3=CC=CC=C3)C(=O)[N+]2=CC=C1)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C2N=C(C(=CNC3=CC=CC=C3)C(=O)[N+]2=CC=C1)SCC4=CC=CC=C4

InChI

InChI=1S/C23H19N3OS/c1-17-9-8-14-26-21(17)25-22(28-16-18-10-4-2-5-11-18)20(23(26)27)15-24-19-12-6-3-7-13-19/h2-15H,16H2,1H3/p+1