5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-phenoxyphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-phenoxyphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-phenoxyphenyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-phenoxyphenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-phenoxyphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-(2-phenoxyphenyl)benzothiophene-2-carboxamide Formula: C29H23BrN2O4S2 MolecularWeight: 607.53792

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=CC=CC=C3OC4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=CC=CC=C3OC4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C29H23BrN2O4S2/c1-2-32(38(34,35)24-15-12-21(30)13-16-24)22-14-17-27-20(18-22)19-28(37-27)29(33)31-25-10-6-7-11-26(25)36-23-8-4-3-5-9-23/h3-19H,2H2,1H3,(H,31,33)