ethyl 1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-1-(2-morpholino-2-oxo-ethyl)-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[2-(4-morpholinyl)-2-oxoethyl]-6-oxo-2-(phenylmethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-1-(2-morpholin-4-yl-2-oxoethyl)-6-oxopyrimidine-5-carboxylate Traditional Name: 2-(benzylthio)-6-keto-1-(2-keto-2-morpholino-ethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)N2CCOCC2)SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)N2CCOCC2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O5S/c1-2-28-19(26)16-12-21-20(29-14-15-6-4-3-5-7-15)23(18(16)25)13-17(24)22-8-10-27-11-9-22/h3-7,12H,2,8-11,13-14H2,1H3