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

Systemtic Name: ethyl 7-methyl-2-[(4-nitrophenyl)methylsulfanyl]-4-oxidanylidene-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 7-methyl-2-[(4-nitrophenyl)methylsulfanyl]-4-oxo-5-(2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-2-[(4-nitrophenyl)methylthio]-4-oxo-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-2-[(4-nitrophenyl)methylsulfanyl]-4-oxo-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-7-methyl-2-[(4-nitrobenzyl)thio]-5-(2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H20N4O5S2 MolecularWeight: 484.548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=O)N=C(N2)SCC4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=O)N=C(N2)SCC4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H20N4O5S2/c1-3-31-21(28)16-12(2)23-19-18(17(16)15-5-4-10-32-15)20(27)25-22(24-19)33-11-13-6-8-14(9-7-13)26(29)30/h4-10,17H,3,11H2,1-2H3,(H2,23,24,25,27)