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

Systemtic Name: 2-[(4-azanyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4-amino-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-amino-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C18H16N6OS MolecularWeight: 364.42424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSC3=NN=C(N3N)C4=CC=CC=C4)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSC3=NN=C(N3N)C4=CC=CC=C4)C=C1

InChI

InChI=1S/C18H16N6OS/c1-12-7-8-15-20-14(9-16(25)23(15)10-12)11-26-18-22-21-17(24(18)19)13-5-3-2-4-6-13/h2-10H,11,19H2,1H3