N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-phenyl-ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-phenyl-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-phenyl-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-phenylethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-phenylethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[4-(2,5-dimethylphenyl)piperazino]-2-phenyl-ethyl]-4-methyl-benzenesulfonamide Formula: C27H33N3O2S MolecularWeight: 463.63482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CC=C2)N3CCN(CC3)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CC=C2)N3CCN(CC3)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H33N3O2S/c1-21-10-13-25(14-11-21)33(31,32)28-20-27(24-7-5-4-6-8-24)30-17-15-29(16-18-30)26-19-22(2)9-12-23(26)3/h4-14,19,27-28H,15-18,20H2,1-3H3