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

Systemtic Name: 9-methyl-3-[[(4-methylphenyl)amino]methylidene]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-benzylsulfanyl-9-methyl-3-[(4-methylanilino)methylene]pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 9-methyl-3-[(4-methylanilino)methylidene]-2-(phenylmethylthio)-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 2-benzylsulfanyl-9-methyl-3-[(4-methylanilino)methylidene]pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(benzylthio)-9-methyl-3-(p-toluidinomethylene)pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C24H22N3OS+ MolecularWeight: 400.51598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC=C2C(=NC3=C(C=CC=[N+]3C2=O)C)SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC=C2C(=NC3=C(C=CC=[N+]3C2=O)C)SCC4=CC=CC=C4

InChI

InChI=1S/C24H21N3OS/c1-17-10-12-20(13-11-17)25-15-21-23(29-16-19-8-4-3-5-9-19)26-22-18(2)7-6-14-27(22)24(21)28/h3-15H,16H2,1-2H3/p+1