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

Systemtic Name: ethyl 2-methylsulfanyl-4-oxidanylidene-7-phenyl-5-pyridin-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-oxo-7-phenyl-5-(2-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-(methylthio)-4-oxo-7-phenyl-5-(2-pyridinyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-oxo-7-phenyl-5-pyridin-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-2-(methylthio)-7-phenyl-5-(2-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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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)SC)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O3S/c1-3-29-21(28)16-15(14-11-7-8-12-23-14)17-19(25-22(30-2)26-20(17)27)24-18(16)13-9-5-4-6-10-13/h4-12,15H,3H2,1-2H3,(H2,24,25,26,27)