2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-methyl-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-methyl-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-methyl-pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methylthio]-3-methyl-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-methylpyrido[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-(4-chlorobenzoyl)benzyl]thio]-3-methyl-pyrido[2,3-d]pyrimidin-4-one Formula: C22H16ClN3O2S MolecularWeight: 421.89934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CC=C2)N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=C(N=CC=C2)N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN3O2S/c1-26-21(28)18-3-2-12-24-20(18)25-22(26)29-13-14-4-6-15(7-5-14)19(27)16-8-10-17(23)11-9-16/h2-12H,13H2,1H3