6-methyl-2-[[(2-phenylsulfanylphenyl)amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 6-methyl-2-[[(2-phenylsulfanylphenyl)amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 6-methyl-2-[(2-phenylsulfanylanilino)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 6-methyl-2-[[2-(phenylthio)anilino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 6-methyl-2-[(2-phenylsulfanylanilino)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 6-methyl-2-[[2-(phenylthio)anilino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H20N3OS+ MolecularWeight: 374.4787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=CC2=O)CNC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=CC2=O)CNC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C22H19N3OS/c1-16-8-7-13-21-24-17(14-22(26)25(16)21)15-23-19-11-5-6-12-20(19)27-18-9-3-2-4-10-18/h2-14,23H,15H2,1H3/p+1