[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C16H13ClN2O5S2 MolecularWeight: 412.86782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)C2=CC=C(S2)Cl)S(=O)(=O)NCCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)C2=CC=C(S2)Cl)S(=O)(=O)NCCC#N

InChI

InChI=1S/C16H13ClN2O5S2/c17-15-7-6-14(25-15)13(20)10-24-16(21)11-2-4-12(5-3-11)26(22,23)19-9-1-8-18/h2-7,19H,1,9-10H2