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

Systemtic Name: ethyl 1-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(2-ethoxyanilino)-2-oxo-ethyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[2-(2-ethoxyanilino)-2-oxoethyl]-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-ethoxyanilino)-2-oxoethyl]-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(o-phenetidino)ethyl]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CN2C(=O)C(=CN=C2SC)C(=O)OCC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CN2C(=O)C(=CN=C2SC)C(=O)OCC

InChI

InChI=1S/C18H21N3O5S/c1-4-25-14-9-7-6-8-13(14)20-15(22)11-21-16(23)12(17(24)26-5-2)10-19-18(21)27-3/h6-10H,4-5,11H2,1-3H3,(H,20,22)