2-[[5-methyl-4-[(2S)-pentan-2-yl]-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-methyl-4-[(2S)-pentan-2-yl]-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-methyl-4-[(1S)-1-methylbutyl]-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-methyl-4-[(2S)-pentan-2-yl]-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[5-methyl-4-[(2S)-pentan-2-yl]-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-methyl-4-[(1S)-1-methylbutyl]-1,2,4-triazol-3-yl]thio]acetate Formula: C10H16N3O2S- MolecularWeight: 242.31794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1C(=NN=C1SCC(=O)[O-])C

Isomeric SMILES

CCC[C@H](C)N1C(=NN=C1SCC(=O)[O-])C

InChI

InChI=1S/C10H17N3O2S/c1-4-5-7(2)13-8(3)11-12-10(13)16-6-9(14)15/h7H,4-6H2,1-3H3,(H,14,15)/p-1/t7-/m0/s1