4-tert-butyl-N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[3-[4-(4-chlorophenyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[3-[4-(4-chlorophenyl)piperazino]propyl]benzenesulfonamide Formula: C23H32ClN3O2S MolecularWeight: 450.03708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H32ClN3O2S/c1-23(2,3)19-5-11-22(12-6-19)30(28,29)25-13-4-14-26-15-17-27(18-16-26)21-9-7-20(24)8-10-21/h5-12,25H,4,13-18H2,1-3H3