8-methyl-2-[(2-methylphenyl)methylsulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 8-methyl-2-[(2-methylphenyl)methylsulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 8-methyl-2-(o-tolylmethylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 8-methyl-2-[[(2-methylphenyl)methylthio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 8-methyl-2-[(2-methylphenyl)methylsulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 8-methyl-2-[[(2-methylbenzyl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C18H19N2OS+ MolecularWeight: 311.42126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C=C1)C(=O)C=C(N2)CSCC3=CC=CC=C3C

Isomeric SMILES

CC1=CC2=[N+](C=C1)C(=O)C=C(N2)CSCC3=CC=CC=C3C

InChI

InChI=1S/C18H18N2OS/c1-13-7-8-20-17(9-13)19-16(10-18(20)21)12-22-11-15-6-4-3-5-14(15)2/h3-10H,11-12H2,1-2H3/p+1