3-(2-bromanylethanoyl)-5-chloranyl-thiophene-2-sulfonamide; 1-[5-chloranyl-2-(phenylmethylsulfanyl)thiophen-3-yl]ethanone

Systemtic Name: 3-(2-bromanylethanoyl)-5-chloranyl-thiophene-2-sulfonamide; 1-[5-chloranyl-2-(phenylmethylsulfanyl)thiophen-3-yl]ethanone Openeye Name: 1-(2-benzylsulfanyl-5-chloro-3-thienyl)ethanone; 3-(2-bromoacetyl)-5-chloro-thiophene-2-sulfonamide CAS Name: 3-(2-bromo-1-oxoethyl)-5-chloro-2-thiophenesulfonamide; 1-[5-chloro-2-(phenylmethylthio)-3-thiophenyl]ethanone IUPAC Name: 1-(2-benzylsulfanyl-5-chlorothiophen-3-yl)ethanone; 3-(2-bromoacetyl)-5-chlorothiophene-2-sulfonamide Traditional Name: 1-[2-(benzylthio)-5-chloro-3-thienyl]ethanone; 3-(2-bromoacetyl)-5-chloro-thiophene-2-sulfonamide Formula: C19H16BrCl2NO4S4 MolecularWeight: 601.40464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(SC(=C1)Cl)SCC2=CC=CC=C2.C1=C(SC(=C1C(=O)CBr)S(=O)(=O)N)Cl

Isomeric SMILES

CC(=O)C1=C(SC(=C1)Cl)SCC2=CC=CC=C2.C1=C(SC(=C1C(=O)CBr)S(=O)(=O)N)Cl

InChI

InChI=1S/C13H11ClOS2.C6H5BrClNO3S2/c1-9(15)11-7-12(14)17-13(11)16-8-10-5-3-2-4-6-10;7-2-4(10)3-1-5(8)13-6(3)14(9,11)12/h2-7H,8H2,1H3;1H,2H2,(H2,9,11,12)