methyl 5-[2-[4-(propan-2-ylsulfamoyl)phenoxy]ethanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[2-[4-(propan-2-ylsulfamoyl)phenoxy]ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[[2-[4-(isopropylsulfamoyl)phenoxy]acetyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[1-oxo-2-[4-(propan-2-ylsulfamoyl)phenoxy]ethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[[2-[4-(propan-2-ylsulfamoyl)phenoxy]acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[2-[4-(isopropylsulfamoyl)phenoxy]acetyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C21H22N2O6S2 MolecularWeight: 462.53918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC

InChI

InChI=1S/C21H22N2O6S2/c1-13(2)23-31(26,27)17-7-5-16(6-8-17)29-12-20(24)22-15-4-9-18-14(10-15)11-19(30-18)21(25)28-3/h4-11,13,23H,12H2,1-3H3,(H,22,24)