N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2-[methylsulfonyl(phenyl)amino]ethanamide

Systemtic Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2-[methylsulfonyl(phenyl)amino]ethanamide Openeye Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2-(N-methylsulfonylanilino)acetamide CAS Name: N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]-2-(N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-2-(N-methylsulfonylanilino)acetamide Traditional Name: 2-(N-mesylanilino)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]acetamide Formula: C17H29N4O3S+ MolecularWeight: 369.50216

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

C[NH+]1CCN(CC1)CCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H28N4O3S/c1-19-11-13-20(14-12-19)10-6-9-18-17(22)15-21(25(2,23)24)16-7-4-3-5-8-16/h3-5,7-8H,6,9-15H2,1-2H3,(H,18,22)/p+1