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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-5-[(4-bromophenyl)sulfonyl-ethyl-amino]benzothiophene-2-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-5-[(4-bromophenyl)sulfonyl-ethylamino]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-5-[(4-bromophenyl)sulfonyl-ethylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-5-[brosyl(ethyl)amino]benzothiophene-2-carboxamide Formula: C30H22BrClN2O4S2 MolecularWeight: 653.99368

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=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=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C30H22BrClN2O4S2/c1-2-34(40(37,38)24-12-8-21(31)9-13-24)23-11-15-27-20(16-23)17-28(39-27)30(36)33-26-14-10-22(32)18-25(26)29(35)19-6-4-3-5-7-19/h3-18H,2H2,1H3,(H,33,36)