[5-(acetyloxymethyl)-2-methylsulfanyl-1-(phenylmethyl)imidazol-4-yl]methyl ethanoate

Systemtic Name: [5-(acetyloxymethyl)-2-methylsulfanyl-1-(phenylmethyl)imidazol-4-yl]methyl ethanoate Openeye Name: [5-(acetoxymethyl)-1-benzyl-2-methylsulfanyl-imidazol-4-yl]methyl acetate CAS Name: acetic acid [5-(acetyloxymethyl)-2-(methylthio)-1-(phenylmethyl)-4-imidazolyl]methyl ester IUPAC Name: [5-(acetyloxymethyl)-1-benzyl-2-methylsulfanylimidazol-4-yl]methyl acetate Traditional Name: acetic acid [5-(acetoxymethyl)-1-benzyl-2-(methylthio)imidazol-4-yl]methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N(C(=N1)SC)CC2=CC=CC=C2)COC(=O)C

Isomeric SMILES

CC(=O)OCC1=C(N(C(=N1)SC)CC2=CC=CC=C2)COC(=O)C

InChI

InChI=1S/C17H20N2O4S/c1-12(20)22-10-15-16(11-23-13(2)21)19(17(18-15)24-3)9-14-7-5-4-6-8-14/h4-8H,9-11H2,1-3H3