5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(3-isopropoxypropyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-(3-isopropoxypropyl)benzothiophene-2-carboxamide Formula: C23H27BrN2O4S2 MolecularWeight: 539.50548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27BrN2O4S2/c1-4-26(32(28,29)20-9-6-18(24)7-10-20)19-8-11-21-17(14-19)15-22(31-21)23(27)25-12-5-13-30-16(2)3/h6-11,14-16H,4-5,12-13H2,1-3H3,(H,25,27)