methyl 4-[[3-(thiophen-2-ylmethylsulfamoyl)phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[3-(thiophen-2-ylmethylsulfamoyl)phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[3-(2-thienylmethylsulfamoyl)benzoyl]amino]butanoate CAS Name: 4-[[oxo-[3-(thiophen-2-ylmethylsulfamoyl)phenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[3-(thiophen-2-ylmethylsulfamoyl)benzoyl]amino]butanoate Traditional Name: 4-[[3-(2-thenylsulfamoyl)benzoyl]amino]butyric acid methyl ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CS2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CS2

InChI

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