5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-butyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-butyl-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-methyl-amino]-N-butyl-benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-butyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-methylamino]-N-butyl-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(methyl)amino]-N-butyl-benzothiophene-2-carboxamide Formula: C20H21BrN2O3S2 MolecularWeight: 481.42634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O3S2/c1-3-4-11-22-20(24)19-13-14-12-16(7-10-18(14)27-19)23(2)28(25,26)17-8-5-15(21)6-9-17/h5-10,12-13H,3-4,11H2,1-2H3,(H,22,24)