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

Systemtic Name: ethyl 5-(3-bromophenyl)-7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-5-(3-bromophenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(3-bromophenyl)-7-methyl-4-oxo-2-(phenylmethylthio)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-5-(3-bromophenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(benzylthio)-5-(3-bromophenyl)-4-keto-7-methyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C24H22BrN3O3S MolecularWeight: 512.41878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Br)C(=O)N=C(N2)SCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Br)C(=O)N=C(N2)SCC4=CC=CC=C4)C

InChI

InChI=1S/C24H22BrN3O3S/c1-3-31-23(30)18-14(2)26-21-20(19(18)16-10-7-11-17(25)12-16)22(29)28-24(27-21)32-13-15-8-5-4-6-9-15/h4-12,19H,3,13H2,1-2H3,(H2,26,27,28,29)