2-(1-propan-2-ylimidazol-2-yl)sulfanylethanoate

Systemtic Name: 2-(1-propan-2-ylimidazol-2-yl)sulfanylethanoate Openeye Name: 2-(1-isopropylimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-propan-2-yl-2-imidazolyl)thio]acetate IUPAC Name: 2-(1-propan-2-ylimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-isopropylimidazol-2-yl)thio]acetate Formula: C8H11N2O2S- MolecularWeight: 199.25014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CN=C1SCC(=O)[O-]

Isomeric SMILES

CC(C)N1C=CN=C1SCC(=O)[O-]

InChI

InChI=1S/C8H12N2O2S/c1-6(2)10-4-3-9-8(10)13-5-7(11)12/h3-4,6H,5H2,1-2H3,(H,11,12)/p-1