2-[[4-methyl-5-(3-oxidanylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-methyl-5-(3-oxidanylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(3-hydroxypropyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[5-(3-hydroxypropyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[5-(3-hydroxypropyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(3-hydroxypropyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid Formula: C8H13N3O3S MolecularWeight: 231.27212

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)O)CCCO

Isomeric SMILES

CN1C(=NN=C1SCC(=O)O)CCCO

InChI

InChI=1S/C8H13N3O3S/c1-11-6(3-2-4-12)9-10-8(11)15-5-7(13)14/h12H,2-5H2,1H3,(H,13,14)