(2S)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2S)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2S)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide CAS Name: (2S)-2-[4-(4-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2S)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2S)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propionamide Formula: C19H24FN4O5S2+ MolecularWeight: 471.546063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN4O5S2/c1-14(19(25)22-16-4-8-17(9-5-16)30(21,26)27)23-10-12-24(13-11-23)31(28,29)18-6-2-15(20)3-7-18/h2-9,14H,10-13H2,1H3,(H,22,25)(H2,21,26,27)/p+1/t14-/m0/s1