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

Systemtic Name: ethyl 2-[5-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[1-benzyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[5-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-benzyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[(1-benzyl-5-methylol-imidazol-2-yl)thio]acetic acid ethyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=C(N1CC2=CC=CC=C2)CO

Isomeric SMILES

CCOC(=O)CSC1=NC=C(N1CC2=CC=CC=C2)CO

InChI

InChI=1S/C15H18N2O3S/c1-2-20-14(19)11-21-15-16-8-13(10-18)17(15)9-12-6-4-3-5-7-12/h3-8,18H,2,9-11H2,1H3