2,5-dimethyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[3-[4-(4-methyl-1-piperazinyl)phenyl]propyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[3-[4-(4-methylpiperazino)phenyl]propyl]benzenesulfonamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCCC2=CC=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCCC2=CC=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C22H31N3O2S/c1-18-6-7-19(2)22(17-18)28(26,27)23-12-4-5-20-8-10-21(11-9-20)25-15-13-24(3)14-16-25/h6-11,17,23H,4-5,12-16H2,1-3H3