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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-ethylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(2-ethylphenyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-ethylphenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-(2-ethylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-(2-ethylphenyl)benzothiophene-2-carboxamide Formula: C25H23BrN2O3S2 MolecularWeight: 543.49572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H23BrN2O3S2/c1-3-17-7-5-6-8-22(17)27-25(29)24-16-18-15-20(11-14-23(18)32-24)28(4-2)33(30,31)21-12-9-19(26)10-13-21/h5-16H,3-4H2,1-2H3,(H,27,29)