N-[1-(azepan-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-bromanyl-benzenesulfonamide

Systemtic Name: N-[1-(azepan-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-bromanyl-benzenesulfonamide Openeye Name: N-[1-(azepane-1-carbonyl)-3-methylsulfanyl-propyl]-4-bromo-benzenesulfonamide CAS Name: N-[1-(1-azepanyl)-4-(methylthio)-1-oxobutan-2-yl]-4-bromobenzenesulfonamide IUPAC Name: N-[1-(azepan-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-4-bromobenzenesulfonamide Traditional Name: N-[1-(azepane-1-carbonyl)-3-(methylthio)propyl]-4-bromo-benzenesulfonamide Formula: C17H25BrN2O3S2 MolecularWeight: 449.426

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCCCC1)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CSCCC(C(=O)N1CCCCCC1)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H25BrN2O3S2/c1-24-13-10-16(17(21)20-11-4-2-3-5-12-20)19-25(22,23)15-8-6-14(18)7-9-15/h6-9,16,19H,2-5,10-13H2,1H3