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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(4-propan-2-ylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(4-isopropylphenyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(4-propan-2-ylphenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(4-propan-2-ylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-p-cumenyl-benzothiophene-2-carboxamide Formula: C26H25BrN2O3S2 MolecularWeight: 557.5223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=CC=C(C=C3)C(C)C)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=CC=C(C=C3)C(C)C)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H25BrN2O3S2/c1-4-29(34(31,32)23-12-7-20(27)8-13-23)22-11-14-24-19(15-22)16-25(33-24)26(30)28-21-9-5-18(6-10-21)17(2)3/h5-17H,4H2,1-3H3,(H,28,30)