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

Systemtic Name: 2-[[4-[(2S)-1-methoxypropan-2-yl]-5-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-isopropyl-4-[(1S)-2-methoxy-1-methyl-ethyl]-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-[(2S)-1-methoxypropan-2-yl]-5-propan-2-yl-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-[(2S)-1-methoxypropan-2-yl]-5-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-isopropyl-4-[(1S)-2-methoxy-1-methyl-ethyl]-1,2,4-triazol-3-yl]thio]acetate Formula: C11H18N3O3S- MolecularWeight: 272.34392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C(C)COC)SCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H19N3O3S/c1-7(2)10-12-13-11(18-6-9(15)16)14(10)8(3)5-17-4/h7-8H,5-6H2,1-4H3,(H,15,16)/p-1/t8-/m0/s1