(phenylmethyl) 2-[5-(hydroxymethyl)-1-[(2-methoxyphenyl)methyl]imidazol-2-yl]sulfanylethanoate

Systemtic Name: (phenylmethyl) 2-[5-(hydroxymethyl)-1-[(2-methoxyphenyl)methyl]imidazol-2-yl]sulfanylethanoate Openeye Name: benzyl 2-[5-(hydroxymethyl)-1-[(2-methoxyphenyl)methyl]imidazol-2-yl]sulfanylacetate CAS Name: 2-[[5-(hydroxymethyl)-1-[(2-methoxyphenyl)methyl]-2-imidazolyl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[5-(hydroxymethyl)-1-[(2-methoxyphenyl)methyl]imidazol-2-yl]sulfanylacetate Traditional Name: 2-[(5-methylol-1-o-anisyl-imidazol-2-yl)thio]acetic acid benzyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=CN=C2SCC(=O)OCC3=CC=CC=C3)CO

Isomeric SMILES

COC1=CC=CC=C1CN2C(=CN=C2SCC(=O)OCC3=CC=CC=C3)CO

InChI

InChI=1S/C21H22N2O4S/c1-26-19-10-6-5-9-17(19)12-23-18(13-24)11-22-21(23)28-15-20(25)27-14-16-7-3-2-4-8-16/h2-11,24H,12-15H2,1H3