2-(4-methylphenyl)sulfanyl-3-(phenylazanylmethylidene)pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-(4-methylphenyl)sulfanyl-3-(phenylazanylmethylidene)pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-(anilinomethylene)-2-(p-tolylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-(anilinomethylidene)-2-[(4-methylphenyl)thio]-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 3-(anilinomethylidene)-2-(4-methylphenyl)sulfanylpyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-(anilinomethylene)-2-(p-tolylthio)pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H18N3OS+ MolecularWeight: 372.46282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC3=CC=CC=[N+]3C(=O)C2=CNC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC3=CC=CC=[N+]3C(=O)C2=CNC4=CC=CC=C4

InChI

InChI=1S/C22H17N3OS/c1-16-10-12-18(13-11-16)27-21-19(15-23-17-7-3-2-4-8-17)22(26)25-14-6-5-9-20(25)24-21/h2-15H,1H3/p+1