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

Systemtic Name: methyl 3-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[[4-[benzyl(methyl)sulfamoyl]benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 3-[[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[benzyl(methyl)sulfamoyl]benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[4-[benzyl(methyl)sulfamoyl]benzoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C25H22N2O5S2 MolecularWeight: 494.58258

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C25H22N2O5S2/c1-27(16-17-8-4-3-5-9-17)34(30,31)19-14-12-18(13-15-19)24(28)26-22-20-10-6-7-11-21(20)33-23(22)25(29)32-2/h3-15H,16H2,1-2H3,(H,26,28)