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

Systemtic Name: dimethyl 5-[[4-chloranyl-3-(thiophen-2-ylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-chloro-3-(2-thienylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[4-chloro-3-(thiophen-2-ylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-chloro-3-(thiophen-2-ylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-chloro-3-(2-thienylamino)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H17ClN2O6S2 MolecularWeight: 480.94178

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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)NC3=CC=CS3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)NC3=CC=CS3)C(=O)OC

InChI

InChI=1S/C20H17ClN2O6S2/c1-28-19(24)12-8-13(20(25)29-2)10-14(9-12)23-31(26,27)15-5-6-16(21)17(11-15)22-18-4-3-7-30-18/h3-11,22-23H,1-2H3