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

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-methyl-3-sulfamoyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 4-methyl-3-sulfamoyl-benzoate CAS Name: 4-methyl-3-sulfamoylbenzoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-methyl-3-sulfamoylbenzoate Traditional Name: 4-methyl-3-sulfamoyl-benzoic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C16H18N2O5S2 MolecularWeight: 382.45452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O5S2/c1-10-5-6-12(8-14(10)25(17,21)22)16(20)23-11(2)15(19)18-9-13-4-3-7-24-13/h3-8,11H,9H2,1-2H3,(H,18,19)(H2,17,21,22)