(2R)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2R)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2R)-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide CAS Name: (2R)-2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2R)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2R)-N-(4-sulfamoylphenyl)-2-(4-tosylpiperazin-1-ium-1-yl)propionamide Formula: C20H27N4O5S2+ MolecularWeight: 467.58218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H26N4O5S2/c1-15-3-7-19(8-4-15)31(28,29)24-13-11-23(12-14-24)16(2)20(25)22-17-5-9-18(10-6-17)30(21,26)27/h3-10,16H,11-14H2,1-2H3,(H,22,25)(H2,21,26,27)/p+1/t16-/m1/s1