2-[1-(2-ethyl-6-methyl-phenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-(2-ethyl-6-methyl-phenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-(2-ethyl-6-methyl-phenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(2-ethyl-6-methylphenyl)-2-imidazolyl]thio]acetate IUPAC Name: 2-[1-(2-ethyl-6-methylphenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2-ethyl-6-methyl-phenyl)imidazol-2-yl]thio]acetate Formula: C14H15N2O2S- MolecularWeight: 275.3461

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N2C=CN=C2SCC(=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1N2C=CN=C2SCC(=O)[O-])C

InChI

InChI=1S/C14H16N2O2S/c1-3-11-6-4-5-10(2)13(11)16-8-7-15-14(16)19-9-12(17)18/h4-8H,3,9H2,1-2H3,(H,17,18)/p-1