2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-(indan-5-ylsulfanylmethyl)-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(2,3-dihydro-1H-inden-5-ylthio)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(indan-5-ylthio)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H19N2OS+ MolecularWeight: 323.43196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C19H18N2OS/c1-13-5-8-18-20-16(10-19(22)21(18)11-13)12-23-17-7-6-14-3-2-4-15(14)9-17/h5-11H,2-4,12H2,1H3/p+1