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

Systemtic Name: dimethyl 5-[[4-chloranyl-3-(thiophen-2-ylcarbonylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-chloro-3-(thiophene-2-carbonylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[4-chloro-3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-chloro-3-(thiophene-2-carbonylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-chloro-3-(2-thenoylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H17ClN2O7S2 MolecularWeight: 508.95188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C21H17ClN2O7S2/c1-30-20(26)12-8-13(21(27)31-2)10-14(9-12)24-33(28,29)15-5-6-16(22)17(11-15)23-19(25)18-4-3-7-32-18/h3-11,24H,1-2H3,(H,23,25)