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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-morpholin-4-ylethyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-morpholinoethyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-[2-(4-morpholinyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-morpholin-4-ylethyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-(2-morpholinoethyl)benzothiophene-2-carboxamide Formula: C23H26BrN3O4S2 MolecularWeight: 552.50424

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCCN3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCCN3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H26BrN3O4S2/c1-2-27(33(29,30)20-6-3-18(24)4-7-20)19-5-8-21-17(15-19)16-22(32-21)23(28)25-9-10-26-11-13-31-14-12-26/h3-8,15-16H,2,9-14H2,1H3,(H,25,28)