N-(3-bromophenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: N-(3-bromophenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(3-bromophenyl)-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzenesulfonamide CAS Name: N-(3-bromophenyl)-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(3-bromophenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: N-(3-bromophenyl)-N-[2-keto-2-(4-tosylpiperazino)ethyl]benzenesulfonamide Formula: C25H26BrN3O5S2 MolecularWeight: 592.52504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26BrN3O5S2/c1-20-10-12-24(13-11-20)35(31,32)28-16-14-27(15-17-28)25(30)19-29(22-7-5-6-21(26)18-22)36(33,34)23-8-3-2-4-9-23/h2-13,18H,14-17,19H2,1H3