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

Systemtic Name: ethyl 7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-pyridin-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-7-methyl-4-oxo-5-(2-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-4-oxo-2-(phenylmethylthio)-5-(2-pyridinyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-7-methyl-4-oxo-5-pyridin-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(benzylthio)-4-keto-7-methyl-5-(2-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=N3)C(=O)N=C(N2)SCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=N3)C(=O)N=C(N2)SCC4=CC=CC=C4)C

InChI

InChI=1S/C23H22N4O3S/c1-3-30-22(29)17-14(2)25-20-19(18(17)16-11-7-8-12-24-16)21(28)27-23(26-20)31-13-15-9-5-4-6-10-15/h4-12,18H,3,13H2,1-2H3,(H2,25,26,27,28)