methyl 3-[[4-(diethylsulfamoyl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(diethylsulfamoyl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[[4-(diethylsulfamoyl)benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 3-[[[4-(diethylsulfamoyl)phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(diethylsulfamoyl)benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[4-(diethylsulfamoyl)benzoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H22N2O5S2/c1-4-23(5-2)30(26,27)15-12-10-14(11-13-15)20(24)22-18-16-8-6-7-9-17(16)29-19(18)21(25)28-3/h6-13H,4-5H2,1-3H3,(H,22,24)