dimethyl 5-[2-(5-ethoxycarbonyl-3-oxidanylidene-thiomorpholin-2-yl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(5-ethoxycarbonyl-3-oxidanylidene-thiomorpholin-2-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(5-ethoxycarbonyl-3-oxo-thiomorpholin-2-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(5-ethoxycarbonyl-3-oxo-2-thiomorpholinyl)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(5-ethoxycarbonyl-3-oxothiomorpholin-2-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(5-carbethoxy-3-keto-thiomorpholin-2-yl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H22N2O8S MolecularWeight: 438.45158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(C(=O)N1)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC(=O)C1CSC(C(=O)N1)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H22N2O8S/c1-4-29-19(26)13-9-30-14(16(23)21-13)8-15(22)20-12-6-10(17(24)27-2)5-11(7-12)18(25)28-3/h5-7,13-14H,4,8-9H2,1-3H3,(H,20,22)(H,21,23)