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

Systemtic Name: methyl 7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-(4-propan-2-ylphenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C26H27N3O3S MolecularWeight: 461.57588

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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)C(C)C)C(=O)OC

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

InChI

InChI=1S/C26H27N3O3S/c1-15(2)18-10-12-19(13-11-18)21-20(25(31)32-4)16(3)27-23-22(21)24(30)29-26(28-23)33-14-17-8-6-5-7-9-17/h5-13,15,21H,14H2,1-4H3,(H2,27,28,29,30)