N'-(2,1,3-benzothiadiazol-5-yl)-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ethanediamide

Systemtic Name: N'-(2,1,3-benzothiadiazol-5-yl)-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ethanediamide Openeye Name: N'-(2,1,3-benzothiadiazol-5-yl)-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]oxamide CAS Name: N'-(2,1,3-benzothiadiazol-5-yl)-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]oxamide IUPAC Name: N'-(2,1,3-benzothiadiazol-5-yl)-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]oxamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N'-piazthiol-5-yl-oxamide Formula: C15H20N5O2S+ MolecularWeight: 334.4166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C(=O)NC2=CC3=NSN=C3C=C2

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C(=O)NC2=CC3=NSN=C3C=C2

InChI

InChI=1S/C15H19N5O2S/c1-2-20-7-3-4-11(20)9-16-14(21)15(22)17-10-5-6-12-13(8-10)19-23-18-12/h5-6,8,11H,2-4,7,9H2,1H3,(H,16,21)(H,17,22)/p+1/t11-/m0/s1