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

Systemtic Name: propan-2-yl 5-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-benzylsulfanyl-5-(4-methoxyphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(4-methoxyphenyl)-7-methyl-4-oxo-2-(phenylmethylthio)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-benzylsulfanyl-5-(4-methoxyphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(benzylthio)-4-keto-5-(4-methoxyphenyl)-7-methyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H27N3O4S/c1-15(2)33-25(31)20-16(3)27-23-22(21(20)18-10-12-19(32-4)13-11-18)24(30)29-26(28-23)34-14-17-8-6-5-7-9-17/h5-13,15,21H,14H2,1-4H3,(H2,27,28,29,30)