4-methyl-N-[2-methyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-methyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1,1-dimethyl-ethyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[2-methyl-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-2-methylpropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-1,1-dimethyl-ethyl]-4-methyl-benzenesulfonamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)(C)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)(C)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O2S/c1-19-9-11-21(12-10-19)28(26,27)23-22(2,3)18-25-15-13-24(14-16-25)17-20-7-5-4-6-8-20/h4-12,23H,13-18H2,1-3H3