4-bromanyl-N-[(2S)-1-(4-ethanoylpiperazin-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(2S)-1-(4-ethanoylpiperazin-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-2-methyl-propyl]-4-bromo-benzenesulfonamide CAS Name: N-[(2S)-1-(4-acetyl-1-piperazinyl)-3-methyl-1-oxobutan-2-yl]-4-bromobenzenesulfonamide IUPAC Name: N-[(2S)-1-(4-acetylpiperazin-1-yl)-3-methyl-1-oxobutan-2-yl]-4-bromobenzenesulfonamide Traditional Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-2-methyl-propyl]-4-bromo-benzenesulfonamide Formula: C17H24BrN3O4S MolecularWeight: 446.35916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C(=O)C)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H24BrN3O4S/c1-12(2)16(17(23)21-10-8-20(9-11-21)13(3)22)19-26(24,25)15-6-4-14(18)5-7-15/h4-7,12,16,19H,8-11H2,1-3H3/t16-/m0/s1