2-[[4-(2-pyridin-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(2-pyridin-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-[2-(2-pyridyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-[2-(2-pyridinyl)ethyl]-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(2-pyridin-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-[2-(2-pyridyl)ethyl]-1,2,4-triazol-3-yl]thio]acetic acid Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCN2C=NN=C2SCC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)CCN2C=NN=C2SCC(=O)O

InChI

InChI=1S/C11H12N4O2S/c16-10(17)7-18-11-14-13-8-15(11)6-4-9-3-1-2-5-12-9/h1-3,5,8H,4,6-7H2,(H,16,17)