methyl 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoate Openeye Name: methyl 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-methyl-5-phenyl-2-imidazolyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetic acid methyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CN1C(=CN=C1SCC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-15-11(10-6-4-3-5-7-10)8-14-13(15)18-9-12(16)17-2/h3-8H,9H2,1-2H3