1-(2-ethylsulfanylethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-(2-ethylsulfanylethyl)-1,2,3-triazole-4-carboxylate Openeye Name: 1-(2-ethylsulfanylethyl)triazole-4-carboxylate CAS Name: 1-[2-(ethylthio)ethyl]-4-triazolecarboxylate IUPAC Name: 1-(2-ethylsulfanylethyl)triazole-4-carboxylate Traditional Name: 1-[2-(ethylthio)ethyl]triazole-4-carboxylate Formula: C7H10N3O2S- MolecularWeight: 200.2382

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN1C=C(N=N1)C(=O)[O-]

Isomeric SMILES

CCSCCN1C=C(N=N1)C(=O)[O-]

InChI

InChI=1S/C7H11N3O2S/c1-2-13-4-3-10-5-6(7(11)12)8-9-10/h5H,2-4H2,1H3,(H,11,12)/p-1