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

Systemtic Name: ethyl 4-oxidanylidene-7-phenyl-2-(phenylmethylsulfanyl)-5-pyridin-3-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-4-oxo-7-phenyl-5-(3-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-oxo-7-phenyl-2-(phenylmethylthio)-5-(3-pyridinyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-4-oxo-7-phenyl-5-pyridin-3-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(benzylthio)-4-keto-7-phenyl-5-(3-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C28H24N4O3S MolecularWeight: 496.58016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CN=CC=C3)C(=O)N=C(N2)SCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CN=CC=C3)C(=O)N=C(N2)SCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O3S/c1-2-35-27(34)22-21(20-14-9-15-29-16-20)23-25(30-24(22)19-12-7-4-8-13-19)31-28(32-26(23)33)36-17-18-10-5-3-6-11-18/h3-16,21H,2,17H2,1H3,(H2,30,31,32,33)