4-bromanyl-N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-[4-(2-methylpropanoyl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(4-isobutyrylpiperazino)-3-keto-propyl]benzenesulfonamide Formula: C17H24BrN3O4S MolecularWeight: 446.35916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H24BrN3O4S/c1-13(2)17(23)21-11-9-20(10-12-21)16(22)7-8-19-26(24,25)15-5-3-14(18)4-6-15/h3-6,13,19H,7-12H2,1-2H3