ethyl 2-methylsulfanyl-6-oxidanylidene-1-[2-oxidanylidene-2-[(3-propan-2-yloxycarbonylphenyl)amino]ethyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-6-oxidanylidene-1-[2-oxidanylidene-2-[(3-propan-2-yloxycarbonylphenyl)amino]ethyl]pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(3-isopropoxycarbonylanilino)-2-oxo-ethyl]-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-6-oxo-1-[2-oxo-2-[3-[oxo(propan-2-yloxy)methyl]anilino]ethyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-6-oxo-1-[2-oxo-2-(3-propan-2-yloxycarbonylanilino)ethyl]pyrimidine-5-carboxylate Traditional Name: 1-[2-(3-isopropoxycarbonylanilino)-2-keto-ethyl]-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC(=C2)C(=O)OC(C)C)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC(=C2)C(=O)OC(C)C)SC

InChI

InChI=1S/C20H23N3O6S/c1-5-28-19(27)15-10-21-20(30-4)23(17(15)25)11-16(24)22-14-8-6-7-13(9-14)18(26)29-12(2)3/h6-10,12H,5,11H2,1-4H3,(H,22,24)