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

Systemtic Name: 2-[[4-[(2S)-1-methoxypropan-2-yl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-[(1S)-2-methoxy-1-methyl-ethyl]-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-[(2S)-1-methoxypropan-2-yl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-[(2S)-1-methoxypropan-2-yl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-[(1S)-2-methoxy-1-methyl-ethyl]-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C12H14N3O3S2- MolecularWeight: 312.38786

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=NN=C1SCC(=O)[O-])C2=CC=CS2

Isomeric SMILES

C[C@@H](COC)N1C(=NN=C1SCC(=O)[O-])C2=CC=CS2

InChI

InChI=1S/C12H15N3O3S2/c1-8(6-18-2)15-11(9-4-3-5-19-9)13-14-12(15)20-7-10(16)17/h3-5,8H,6-7H2,1-2H3,(H,16,17)/p-1/t8-/m0/s1