N,N-diethyl-2-[4-[4-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[4-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-[4-[(4-fluoro-3-methyl-phenyl)sulfonylamino]benzoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[[4-[(4-fluoro-3-methylphenyl)sulfonylamino]phenyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-[4-[(4-fluoro-3-methylphenyl)sulfonylamino]benzoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-[4-[(4-fluoro-3-methyl-phenyl)sulfonylamino]benzoyl]piperazin-1-ium-1-yl]acetamide Formula: C24H32FN4O4S+ MolecularWeight: 491.598683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31FN4O4S/c1-4-28(5-2)23(30)17-27-12-14-29(15-13-27)24(31)19-6-8-20(9-7-19)26-34(32,33)21-10-11-22(25)18(3)16-21/h6-11,16,26H,4-5,12-15,17H2,1-3H3/p+1