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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C(C)COC)SCC(=O)[O-]

Isomeric SMILES

CCCC1=NN=C(N1[C@H](C)COC)SCC(=O)[O-]

InChI

InChI=1S/C11H19N3O3S/c1-4-5-9-12-13-11(18-7-10(15)16)14(9)8(2)6-17-3/h8H,4-7H2,1-3H3,(H,15,16)/p-1/t8-/m1/s1