(2S)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2S)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2S)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide CAS Name: (2S)-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2S)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2S)-2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]-N-(4-sulfamoylphenyl)propionamide Formula: C19H30N5O4S+ MolecularWeight: 424.5376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)N2CC[NH+](CC2)CC(=O)N3CCCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)N2CC[NH+](CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C19H29N5O4S/c1-15(19(26)21-16-4-6-17(7-5-16)29(20,27)28)23-12-10-22(11-13-23)14-18(25)24-8-2-3-9-24/h4-7,15H,2-3,8-14H2,1H3,(H,21,26)(H2,20,27,28)/p+1/t15-/m0/s1