N-(2-aminophenyl)-5-[[(4-methoxyphenyl)methyl-(phenylsulfonyl)amino]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-5-[[(4-methoxyphenyl)methyl-(phenylsulfonyl)amino]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-[[benzenesulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[[benzenesulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-5-[[benzenesulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-[[besyl(p-anisyl)amino]methyl]benzothiophene-2-carboxamide Formula: C30H27N3O4S2 MolecularWeight: 557.68308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC=C4N)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC=C4N)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H27N3O4S2/c1-37-24-14-11-21(12-15-24)19-33(39(35,36)25-7-3-2-4-8-25)20-22-13-16-28-23(17-22)18-29(38-28)30(34)32-27-10-6-5-9-26(27)31/h2-18H,19-20,31H2,1H3,(H,32,34)