dimethyl 5-[2-(3-ethoxycarbonylthiomorpholin-4-yl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(3-ethoxycarbonylthiomorpholin-4-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(3-ethoxycarbonylthiomorpholin-4-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(3-ethoxycarbonyl-4-thiomorpholinyl)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(3-ethoxycarbonylthiomorpholin-4-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(3-carbethoxythiomorpholin-4-yl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H24N2O7S MolecularWeight: 424.46806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC(=O)C1CSCCN1CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H24N2O7S/c1-4-28-19(25)15-11-29-6-5-21(15)10-16(22)20-14-8-12(17(23)26-2)7-13(9-14)18(24)27-3/h7-9,15H,4-6,10-11H2,1-3H3,(H,20,22)