2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylethylazanium

Systemtic Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylethylazanium Openeye Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylethylammonium CAS Name: 2-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]sulfonyl]ethylammonium IUPAC Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylethylazanium Traditional Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]sulfonylethylammonium Formula: C13H18N3O2S2+ MolecularWeight: 312.43092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC[NH3+])C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)CC[NH3+])C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H17N3O2S2/c14-7-9-20(17,18)16-8-3-5-11(16)13-15-10-4-1-2-6-12(10)19-13/h1-2,4,6,11H,3,5,7-9,14H2/p+1/t11-/m0/s1