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

Systemtic Name: 4-bromanyl-N-[3-oxidanylidene-3-[4-(phenylcarbonyl)piperazin-1-yl]propyl]benzenesulfonamide Openeye Name: N-[3-(4-benzoylpiperazin-1-yl)-3-oxo-propyl]-4-bromo-benzenesulfonamide CAS Name: N-[3-(4-benzoyl-1-piperazinyl)-3-oxopropyl]-4-bromobenzenesulfonamide IUPAC Name: N-[3-(4-benzoylpiperazin-1-yl)-3-oxopropyl]-4-bromobenzenesulfonamide Traditional Name: N-[3-(4-benzoylpiperazino)-3-keto-propyl]-4-bromo-benzenesulfonamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22BrN3O4S/c21-17-6-8-18(9-7-17)29(27,28)22-11-10-19(25)23-12-14-24(15-13-23)20(26)16-4-2-1-3-5-16/h1-9,22H,10-15H2