4-sulfanyl-2-(1,2,3-triazol-1-yl)hexanoic acid

Systemtic Name: 4-sulfanyl-2-(1,2,3-triazol-1-yl)hexanoic acid Openeye Name: 4-sulfanyl-2-(triazol-1-yl)hexanoic acid CAS Name: 4-mercapto-2-(1-triazolyl)hexanoic acid IUPAC Name: 4-sulfanyl-2-(triazol-1-yl)hexanoic acid Traditional Name: 4-mercapto-2-(triazol-1-yl)hexanoic acid Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(=O)O)N1C=CN=N1)S

Isomeric SMILES

CCC(CC(C(=O)O)N1C=CN=N1)S

InChI

InChI=1S/C8H13N3O2S/c1-2-6(14)5-7(8(12)13)11-4-3-9-10-11/h3-4,6-7,14H,2,5H2,1H3,(H,12,13)