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

Systemtic Name: methyl 5-[2-[2-methyl-4-(phenylsulfamoyl)phenoxy]ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[[2-[2-methyl-4-(phenylsulfamoyl)phenoxy]acetyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[2-[2-methyl-4-(phenylsulfamoyl)phenoxy]-1-oxoethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[[2-[2-methyl-4-(phenylsulfamoyl)phenoxy]acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[2-[2-methyl-4-(phenylsulfamoyl)phenoxy]acetyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C25H22N2O6S2 MolecularWeight: 510.58198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC=C2)OCC(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC=C2)OCC(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)OC

InChI

InChI=1S/C25H22N2O6S2/c1-16-12-20(35(30,31)27-18-6-4-3-5-7-18)9-10-21(16)33-15-24(28)26-19-8-11-22-17(13-19)14-23(34-22)25(29)32-2/h3-14,27H,15H2,1-2H3,(H,26,28)