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

Systemtic Name: ethyl 2-[(4-nitrophenyl)methylsulfanyl]-4-oxidanylidene-7-phenyl-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[(4-nitrophenyl)methylsulfanyl]-4-oxo-7-phenyl-5-(2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(4-nitrophenyl)methylthio]-4-oxo-7-phenyl-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-nitrophenyl)methylsulfanyl]-4-oxo-7-phenyl-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-2-[(4-nitrobenzyl)thio]-7-phenyl-5-(2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C27H22N4O5S2 MolecularWeight: 546.61738

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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-])C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=O)N=C(N2)SCC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O5S2/c1-2-36-26(33)21-20(19-9-6-14-37-19)22-24(28-23(21)17-7-4-3-5-8-17)29-27(30-25(22)32)38-15-16-10-12-18(13-11-16)31(34)35/h3-14,20H,2,15H2,1H3,(H2,28,29,30,32)