[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 3-thiophen-3-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 3-thiophen-3-ylpropanoate Openeye Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-thienyl)propionic acid [2-keto-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)COC(=O)CCC2=CSC=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)COC(=O)CCC2=CSC=C2)S(=O)(=O)N

InChI

InChI=1S/C17H20N2O5S2/c18-26(22,23)15-4-1-13(2-5-15)7-9-19-16(20)11-24-17(21)6-3-14-8-10-25-12-14/h1-2,4-5,8,10,12H,3,6-7,9,11H2,(H,19,20)(H2,18,22,23)