[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-(propylsulfamoyl)benzoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-(propylsulfamoyl)benzoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 3-(propylsulfamoyl)benzoate CAS Name: 3-(propylsulfamoyl)benzoic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-(propylsulfamoyl)benzoate Traditional Name: 3-(propylsulfamoyl)benzoic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C17H17N3O5S2 MolecularWeight: 407.46398

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C17H17N3O5S2/c1-2-7-19-27(23,24)14-5-3-4-12(9-14)17(22)25-11-15(21)20-16-13(10-18)6-8-26-16/h3-6,8-9,19H,2,7,11H2,1H3,(H,20,21)