[4-[(2-ethanoylsulfanylimidazol-1-yl)methyl]-2-fluoranyl-phenyl] ethanoate

Systemtic Name: [4-[(2-ethanoylsulfanylimidazol-1-yl)methyl]-2-fluoranyl-phenyl] ethanoate Openeye Name: [4-[(2-acetylsulfanylimidazol-1-yl)methyl]-2-fluoro-phenyl] acetate CAS Name: acetic acid [4-[[2-(acetylthio)-1-imidazolyl]methyl]-2-fluorophenyl] ester IUPAC Name: [4-[(2-acetylsulfanylimidazol-1-yl)methyl]-2-fluorophenyl] acetate Traditional Name: acetic acid [4-[[2-(acetylthio)imidazol-1-yl]methyl]-2-fluoro-phenyl] ester Formula: C14H13FN2O3S MolecularWeight: 308.328023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CN2C=CN=C2SC(=O)C)F

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CN2C=CN=C2SC(=O)C)F

InChI

InChI=1S/C14H13FN2O3S/c1-9(18)20-13-4-3-11(7-12(13)15)8-17-6-5-16-14(17)21-10(2)19/h3-7H,8H2,1-2H3