[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-chloranyl-3-(cyclopropylsulfamoyl)benzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-chloranyl-3-(cyclopropylsulfamoyl)benzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 4-chloro-3-(cyclopropylsulfamoyl)benzoate CAS Name: 4-chloro-3-(cyclopropylsulfamoyl)benzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 4-chloro-3-(cyclopropylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(cyclopropylsulfamoyl)benzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H16ClN3O5S MolecularWeight: 385.82264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NCCC#N)Cl

Isomeric SMILES

C1CC1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NCCC#N)Cl

InChI

InChI=1S/C15H16ClN3O5S/c16-12-5-2-10(8-13(12)25(22,23)19-11-3-4-11)15(21)24-9-14(20)18-7-1-6-17/h2,5,8,11,19H,1,3-4,7,9H2,(H,18,20)