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

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSC3=NN=C(N3C)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSC3=NN=C(N3C)C)C=C1

InChI

InChI=1S/C14H15N5OS/c1-9-4-5-12-15-11(6-13(20)19(12)7-9)8-21-14-17-16-10(2)18(14)3/h4-7H,8H2,1-3H3