methyl 5-[[4-methoxy-3-[(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[[4-methoxy-3-[(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[[3-(benzylsulfamoyl)-4-methoxy-benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[[4-methoxy-3-[(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[[3-(benzylsulfamoyl)-4-methoxybenzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[3-(benzylsulfamoyl)-4-methoxy-benzoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C25H22N2O6S2 MolecularWeight: 510.58198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC)S(=O)(=O)NCC4=CC=CC=C4

InChI

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