N-[(2S)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-ethyl]benzenesulfonamide

Systemtic Name: N-[(2S)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-ethyl]benzenesulfonamide Openeye Name: N-[(2S)-2-phenyl-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzenesulfonamide CAS Name: N-[(2S)-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-phenylethyl]benzenesulfonamide IUPAC Name: N-[(2S)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenylethyl]benzenesulfonamide Traditional Name: N-[(2S)-2-phenyl-2-(4-tosylpiperazino)ethyl]benzenesulfonamide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)[C@H](CNS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O4S2/c1-21-12-14-24(15-13-21)34(31,32)28-18-16-27(17-19-28)25(22-8-4-2-5-9-22)20-26-33(29,30)23-10-6-3-7-11-23/h2-15,25-26H,16-20H2,1H3/t25-/m1/s1