2-[1-(4-propan-2-yloxyphenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-(4-propan-2-yloxyphenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-(4-isopropoxyphenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(4-propan-2-yloxyphenyl)-2-imidazolyl]thio]acetate IUPAC Name: 2-[1-(4-propan-2-yloxyphenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(4-isopropoxyphenyl)imidazol-2-yl]thio]acetate Formula: C14H15N2O3S- MolecularWeight: 291.3455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)N2C=CN=C2SCC(=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)N2C=CN=C2SCC(=O)[O-]

InChI

InChI=1S/C14H16N2O3S/c1-10(2)19-12-5-3-11(4-6-12)16-8-7-15-14(16)20-9-13(17)18/h3-8,10H,9H2,1-2H3,(H,17,18)/p-1