N-(4-methylphenyl)-2-[4-[2-[(4-methylphenyl)sulfonylamino]ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[2-[(4-methylphenyl)sulfonylamino]ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(p-tolyl)-2-[4-[2-(p-tolylsulfonylamino)ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-methylphenyl)-2-[4-[2-[(4-methylphenyl)sulfonylamino]ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[2-[(4-methylphenyl)sulfonylamino]ethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(p-tolyl)-2-[4-[2-(tosylamino)ethyl]piperazin-1-ium-1-yl]acetamide Formula: C22H31N4O3S+ MolecularWeight: 431.57154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)CCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)CCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H30N4O3S/c1-18-3-7-20(8-4-18)24-22(27)17-26-15-13-25(14-16-26)12-11-23-30(28,29)21-9-5-19(2)6-10-21/h3-10,23H,11-17H2,1-2H3,(H,24,27)/p+1