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

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-5,7-diphenyl-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 2-(o-tolylmethylsulfanyl)-5,7-diphenyl-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-[(2-methylphenyl)methylthio]-5,7-diphenyl-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-5,7-diphenyl-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-methylbenzyl)thio]-5,7-diphenyl-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C27H21N3OS MolecularWeight: 435.54014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC(=O)C3=C(N2)N=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC(=O)C3=C(N2)N=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H21N3OS/c1-18-10-8-9-15-21(18)17-32-27-29-25-24(26(31)30-27)22(19-11-4-2-5-12-19)16-23(28-25)20-13-6-3-7-14-20/h2-16H,17H2,1H3,(H,28,29,30,31)