methyl 3-[[2-(phenethylcarbamoyl)phenyl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-(phenethylcarbamoyl)phenyl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(phenethylcarbamoyl)phenyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[2-[oxo-(phenethylamino)methyl]phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(phenethylcarbamoyl)phenyl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[2-(phenethylcarbamoyl)phenyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O5S2/c1-28-21(25)19-18(12-14-29-19)30(26,27)23-17-10-6-5-9-16(17)20(24)22-13-11-15-7-3-2-4-8-15/h2-10,12,14,23H,11,13H2,1H3,(H,22,24)