[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 3-(4-sulfamoylphenyl)propanoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 3-(4-sulfamoylphenyl)propanoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 3-(4-sulfamoylphenyl)propanoate CAS Name: 3-(4-sulfamoylphenyl)propanoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 3-(4-sulfamoylphenyl)propanoate Traditional Name: 3-(4-sulfamoylphenyl)propionic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H20N2O5S2/c1-12(17(21)19-11-14-3-2-10-25-14)24-16(20)9-6-13-4-7-15(8-5-13)26(18,22)23/h2-5,7-8,10,12H,6,9,11H2,1H3,(H,19,21)(H2,18,22,23)