2-[1-[(2S)-1-methoxypropan-2-yl]benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-[(2S)-1-methoxypropan-2-yl]benzimidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-[(1S)-2-methoxy-1-methyl-ethyl]benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[(2S)-1-methoxypropan-2-yl]-2-benzimidazolyl]thio]acetate IUPAC Name: 2-[1-[(2S)-1-methoxypropan-2-yl]benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-[(1S)-2-methoxy-1-methyl-ethyl]benzimidazol-2-yl]thio]acetate Formula: C13H15N2O3S- MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C2=CC=CC=C2N=C1SCC(=O)[O-]

Isomeric SMILES

C[C@@H](COC)N1C2=CC=CC=C2N=C1SCC(=O)[O-]

InChI

InChI=1S/C13H16N2O3S/c1-9(7-18-2)15-11-6-4-3-5-10(11)14-13(15)19-8-12(16)17/h3-6,9H,7-8H2,1-2H3,(H,16,17)/p-1/t9-/m0/s1