dimethyl 5-[4-(thiophen-2-ylcarbonylamino)butanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[4-(thiophen-2-ylcarbonylamino)butanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[4-(thiophene-2-carbonylamino)butanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-4-[[oxo(thiophen-2-yl)methyl]amino]butyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(thiophene-2-carbonylamino)butanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[4-(2-thenoylamino)butanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCNC(=O)C2=CC=CS2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCNC(=O)C2=CC=CS2)C(=O)OC

InChI

InChI=1S/C19H20N2O6S/c1-26-18(24)12-9-13(19(25)27-2)11-14(10-12)21-16(22)6-3-7-20-17(23)15-5-4-8-28-15/h4-5,8-11H,3,6-7H2,1-2H3,(H,20,23)(H,21,22)