methyl 2-[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylacetate CAS Name: 2-[[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-2-imidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]imidazol-2-yl]sulfanylacetate Traditional Name: 2-[(5-methylol-1-p-anisyl-imidazol-2-yl)thio]acetic acid methyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=CN=C2SCC(=O)OC)CO

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=CN=C2SCC(=O)OC)CO

InChI

InChI=1S/C15H18N2O4S/c1-20-13-5-3-11(4-6-13)8-17-12(9-18)7-16-15(17)22-10-14(19)21-2/h3-7,18H,8-10H2,1-2H3