5,7-dimethyl-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 5,7-dimethyl-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 5,7-dimethyl-2-(p-tolylmethylsulfanyl)-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 5,7-dimethyl-2-[(4-methylphenyl)methylthio]-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 5,7-dimethyl-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 5,7-dimethyl-2-[(4-methylbenzyl)thio]-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=O)C3=C(N2)N=C(C=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=O)C3=C(N2)N=C(C=C3C)C

InChI

InChI=1S/C17H17N3OS/c1-10-4-6-13(7-5-10)9-22-17-19-15-14(16(21)20-17)11(2)8-12(3)18-15/h4-8H,9H2,1-3H3,(H,18,19,20,21)