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

Systemtic Name: ethyl 5-(4-ethoxyphenyl)-2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-(4-ethoxyphenyl)-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(4-ethoxyphenyl)-2-[(2-fluorophenyl)methylthio]-4-oxo-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-ethoxyphenyl)-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(2-fluorobenzyl)thio]-4-keto-7-phenyl-5-p-phenetyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C31H28FN3O4S MolecularWeight: 557.635123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C3=C(NC(=C2C(=O)OCC)C4=CC=CC=C4)NC(=NC3=O)SCC5=CC=CC=C5F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C3=C(NC(=C2C(=O)OCC)C4=CC=CC=C4)NC(=NC3=O)SCC5=CC=CC=C5F

InChI

InChI=1S/C31H28FN3O4S/c1-3-38-22-16-14-19(15-17-22)24-25(30(37)39-4-2)27(20-10-6-5-7-11-20)33-28-26(24)29(36)35-31(34-28)40-18-21-12-8-9-13-23(21)32/h5-17,24H,3-4,18H2,1-2H3,(H2,33,34,35,36)