(2R)-2-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate

Systemtic Name: (2R)-2-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: (2R)-2-[(5-isobutyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoate CAS Name: (2R)-2-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]thio]propanoate IUPAC Name: (2R)-2-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: (2R)-2-[(5-isobutyl-4-methyl-1,2,4-triazol-3-yl)thio]propionate Formula: C10H16N3O2S- MolecularWeight: 242.31794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(N1C)SC(C)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C10H17N3O2S/c1-6(2)5-8-11-12-10(13(8)4)16-7(3)9(14)15/h6-7H,5H2,1-4H3,(H,14,15)/p-1/t7-/m1/s1