3-(2-azanyl-1,3-thiazol-3-ium-3-yl)propane-1-sulfonate

Systemtic Name: 3-(2-azanyl-1,3-thiazol-3-ium-3-yl)propane-1-sulfonate Openeye Name: 3-(2-aminothiazol-3-ium-3-yl)propane-1-sulfonate CAS Name: 3-(2-amino-3-thiazol-3-iumyl)-1-propanesulfonate IUPAC Name: 3-(2-amino-1,3-thiazol-3-ium-3-yl)propane-1-sulfonate Traditional Name: 3-(2-aminothiazol-3-ium-3-yl)propane-1-sulfonate Formula: C6H10N2O3S2 MolecularWeight: 222.2852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=[N+]1CCCS(=O)(=O)[O-])N

Isomeric SMILES

C1=CSC(=[N+]1CCCS(=O)(=O)[O-])N

InChI

InChI=1S/C6H10N2O3S2/c7-6-8(3-4-12-6)2-1-5-13(9,10)11/h3-4,7H,1-2,5H2,(H,9,10,11)