2-[[4-azanyl-5-(6-methylpyridin-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-azanyl-5-(6-methylpyridin-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-amino-5-(6-methyl-2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-amino-5-(6-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-amino-5-(6-methylpyridin-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-amino-5-(6-methyl-2-pyridyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C10H11N5O2S MolecularWeight: 265.29164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C2=NN=C(N2N)SCC(=O)O

Isomeric SMILES

CC1=CC=CC(=N1)C2=NN=C(N2N)SCC(=O)O

InChI

InChI=1S/C10H11N5O2S/c1-6-3-2-4-7(12-6)9-13-14-10(15(9)11)18-5-8(16)17/h2-4H,5,11H2,1H3,(H,16,17)