4-tert-butyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

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