[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 3,4-dimethyl-5-sulfamoyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 3,4-dimethyl-5-sulfamoyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 3,4-dimethyl-5-sulfamoylbenzoate Traditional Name: 3,4-dimethyl-5-sulfamoyl-benzoic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)OC(C)C(=O)NCC2=CC=CS2)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)OC(C)C(=O)NCC2=CC=CS2)S(=O)(=O)N)C

InChI

InChI=1S/C17H20N2O5S2/c1-10-7-13(8-15(11(10)2)26(18,22)23)17(21)24-12(3)16(20)19-9-14-5-4-6-25-14/h4-8,12H,9H2,1-3H3,(H,19,20)(H2,18,22,23)