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

Systemtic Name: methyl 2-[[4-(diethylsulfamoyl)phenyl]carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[4-(diethylsulfamoyl)benzoyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[[4-(diethylsulfamoyl)phenyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(diethylsulfamoyl)benzoyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(diethylsulfamoyl)benzoyl]amino]benzothiophene-3-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(C3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C3=CC=CC=C3S2)C(=O)OC

InChI

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