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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-methoxyphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-methoxyphenyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-methoxyphenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-methoxyphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-(2-methoxyphenyl)benzothiophene-2-carboxamide Formula: C24H21BrN2O4S2 MolecularWeight: 545.46854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=CC=CC=C3OC)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=CC=CC=C3OC)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H21BrN2O4S2/c1-3-27(33(29,30)19-11-8-17(25)9-12-19)18-10-13-22-16(14-18)15-23(32-22)24(28)26-20-6-4-5-7-21(20)31-2/h4-15H,3H2,1-2H3,(H,26,28)