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

Systemtic Name: dimethyl 5-[2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(5-morpholinosulfonyl-2-thienyl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[5-(4-morpholinylsulfonyl)-2-thiophenyl]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(5-morpholinosulfonyl-2-thienyl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H22N2O8S2 MolecularWeight: 482.52728

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCOCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCOCC3)C(=O)OC

InChI

InChI=1S/C20H22N2O8S2/c1-28-19(24)13-9-14(20(25)29-2)11-15(10-13)21-17(23)12-16-3-4-18(31-16)32(26,27)22-5-7-30-8-6-22/h3-4,9-11H,5-8,12H2,1-2H3,(H,21,23)