(2R)-4-methylsulfanyl-2-(4-sulfanylidene-1,3,5-triazinan-1-ium-1-yl)butanoate

Systemtic Name: (2R)-4-methylsulfanyl-2-(4-sulfanylidene-1,3,5-triazinan-1-ium-1-yl)butanoate Openeye Name: (2R)-4-methylsulfanyl-2-(4-thioxo-1,3,5-triazinan-1-ium-1-yl)butanoate CAS Name: (2R)-4-(methylthio)-2-(4-sulfanylidene-1,3,5-triazinan-1-ium-1-yl)butanoate IUPAC Name: (2R)-4-methylsulfanyl-2-(4-sulfanylidene-1,3,5-triazinan-1-ium-1-yl)butanoate Traditional Name: (2R)-4-(methylthio)-2-(4-thioxo-1,3,5-triazinan-1-ium-1-yl)butyrate Formula: C8H15N3O2S2 MolecularWeight: 249.3536

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])[NH+]1CNC(=S)NC1

Isomeric SMILES

CSCC[C@H](C(=O)[O-])[NH+]1CNC(=S)NC1

InChI

InChI=1S/C8H15N3O2S2/c1-15-3-2-6(7(12)13)11-4-9-8(14)10-5-11/h6H,2-5H2,1H3,(H,12,13)(H2,9,10,14)/t6-/m1/s1