ethyl 1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-[2-(homoveratrylamino)-2-keto-ethyl]-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NCCC2=CC(=C(C=C2)OC)OC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NCCC2=CC(=C(C=C2)OC)OC)SC

InChI

InChI=1S/C20H25N3O6S/c1-5-29-19(26)14-11-22-20(30-4)23(18(14)25)12-17(24)21-9-8-13-6-7-15(27-2)16(10-13)28-3/h6-7,10-11H,5,8-9,12H2,1-4H3,(H,21,24)