ethyl 1-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-1-[2-(4-ethoxyanilino)-2-oxo-ethyl]-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[2-(4-ethoxyanilino)-2-oxoethyl]-6-oxo-2-(phenylmethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-1-[2-(4-ethoxyanilino)-2-oxoethyl]-6-oxopyrimidine-5-carboxylate Traditional Name: 2-(benzylthio)-6-keto-1-[2-keto-2-(p-phenetidino)ethyl]pyrimidine-5-carboxylic acid ethyl ester Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CN=C2SCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CN=C2SCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C24H25N3O5S/c1-3-31-19-12-10-18(11-13-19)26-21(28)15-27-22(29)20(23(30)32-4-2)14-25-24(27)33-16-17-8-6-5-7-9-17/h5-14H,3-4,15-16H2,1-2H3,(H,26,28)