2-[(3,4-dimethylphenyl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(3,4-dimethylphenyl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(3,4-dimethylphenyl)sulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(3,4-dimethylphenyl)thio]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(3,4-dimethylphenyl)sulfanylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(3,4-dimethylphenyl)thio]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSC3=CC(=C(C=C3)C)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSC3=CC(=C(C=C3)C)C)C=C1

InChI

InChI=1S/C18H18N2OS/c1-12-4-7-17-19-15(9-18(21)20(17)10-12)11-22-16-6-5-13(2)14(3)8-16/h4-10H,11H2,1-3H3