(2R)-2-[[4-azanyl-5-(ethylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate

Systemtic Name: (2R)-2-[[4-azanyl-5-(ethylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: (2R)-2-[[4-amino-5-(ethylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: (2R)-2-[[4-amino-5-[(ethylthio)methyl]-1,2,4-triazol-3-yl]thio]propanoate IUPAC Name: (2R)-2-[[4-amino-5-(ethylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: (2R)-2-[[4-amino-5-[(ethylthio)methyl]-1,2,4-triazol-3-yl]thio]propionate Formula: C8H13N4O2S2- MolecularWeight: 261.34442

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=NN=C(N1N)SC(C)C(=O)[O-]

Isomeric SMILES

CCSCC1=NN=C(N1N)S[C@H](C)C(=O)[O-]

InChI

InChI=1S/C8H14N4O2S2/c1-3-15-4-6-10-11-8(12(6)9)16-5(2)7(13)14/h5H,3-4,9H2,1-2H3,(H,13,14)/p-1/t5-/m1/s1