1-(2-propylsulfanylethyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-propylsulfanylethyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-propylsulfanylethyl)triazole-4-carboxylic acid CAS Name: 1-[2-(propylthio)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-(2-propylsulfanylethyl)triazole-4-carboxylic acid Traditional Name: 1-[2-(propylthio)ethyl]triazole-4-carboxylic acid Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCN1C=C(N=N1)C(=O)O

Isomeric SMILES

CCCSCCN1C=C(N=N1)C(=O)O

InChI

InChI=1S/C8H13N3O2S/c1-2-4-14-5-3-11-6-7(8(12)13)9-10-11/h6H,2-5H2,1H3,(H,12,13)