N-cyclopropyl-2-[4-[4-(2-thiophen-2-ylethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[4-(2-thiophen-2-ylethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[4-[2-(2-thienyl)ethylsulfamoyl]benzoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[oxo-[4-(2-thiophen-2-ylethylsulfamoyl)phenyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[4-(2-thiophen-2-ylethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[4-[2-(2-thienyl)ethylsulfamoyl]benzoyl]piperazin-1-ium-1-yl]acetamide Formula: C22H29N4O4S2+ MolecularWeight: 477.62006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC4=CC=CS4

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC4=CC=CS4

InChI

InChI=1S/C22H28N4O4S2/c27-21(24-18-5-6-18)16-25-11-13-26(14-12-25)22(28)17-3-7-20(8-4-17)32(29,30)23-10-9-19-2-1-15-31-19/h1-4,7-8,15,18,23H,5-6,9-14,16H2,(H,24,27)/p+1