propan-2-yl 7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-(4-propan-2-ylphenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-(4-propan-2-ylphenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-benzylsulfanyl-5-(4-isopropylphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-4-oxo-2-(phenylmethylthio)-5-(4-propan-2-ylphenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-benzylsulfanyl-7-methyl-4-oxo-5-(4-propan-2-ylphenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(benzylthio)-4-keto-7-methyl-5-p-cumenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C28H31N3O3S MolecularWeight: 489.62904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=CC=C3)C4=CC=C(C=C4)C(C)C)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=CC=C3)C4=CC=C(C=C4)C(C)C)C(=O)OC(C)C

InChI

InChI=1S/C28H31N3O3S/c1-16(2)20-11-13-21(14-12-20)23-22(27(33)34-17(3)4)18(5)29-25-24(23)26(32)31-28(30-25)35-15-19-9-7-6-8-10-19/h6-14,16-17,23H,15H2,1-5H3,(H2,29,30,31,32)