7-methyl-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-methyl-2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-methyl-2-[[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-methyl-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-methyl-2-[[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC(=O)N4C=C(C=CC4=N3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC(=O)N4C=C(C=CC4=N3)C

InChI

InChI=1S/C19H17N5OS/c1-12-3-6-14(7-4-12)18-21-19(23-22-18)26-11-15-9-17(25)24-10-13(2)5-8-16(24)20-15/h3-10H,11H2,1-2H3,(H,21,22,23)