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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-pentan-2-yl-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-(1-methylbutyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-pentan-2-yl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-pentan-2-yl-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-(1-methylbutyl)benzothiophene-2-carboxamide Formula: C22H25BrN2O3S2 MolecularWeight: 509.4795

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC2=C(S1)C=CC(=C2)N(CC)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCC(C)NC(=O)C1=CC2=C(S1)C=CC(=C2)N(CC)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H25BrN2O3S2/c1-4-6-15(3)24-22(26)21-14-16-13-18(9-12-20(16)29-21)25(5-2)30(27,28)19-10-7-17(23)8-11-19/h7-15H,4-6H2,1-3H3,(H,24,26)