(2S)-2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid

Systemtic Name: (2S)-2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Openeye Name: (2S)-2-[[4-methyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid CAS Name: (2S)-2-[[4-methyl-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]propanoic acid IUPAC Name: (2S)-2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Traditional Name: (2S)-2-[[4-methyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]propionic acid Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NN=C(N1C)C2=CC=CC=N2

Isomeric SMILES

C[C@@H](C(=O)O)SC1=NN=C(N1C)C2=CC=CC=N2

InChI

InChI=1S/C11H12N4O2S/c1-7(10(16)17)18-11-14-13-9(15(11)2)8-5-3-4-6-12-8/h3-7H,1-2H3,(H,16,17)/t7-/m0/s1