cyanomethyl 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: cyanomethyl 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: cyanomethyl 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid cyanomethyl ester Formula: C13H10FN3O2S MolecularWeight: 291.300803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)N2C=CN=C2SCC(=O)OCC#N

Isomeric SMILES

C1=CC(=CC(=C1)F)N2C=CN=C2SCC(=O)OCC#N

InChI

InChI=1S/C13H10FN3O2S/c14-10-2-1-3-11(8-10)17-6-5-16-13(17)20-9-12(18)19-7-4-15/h1-3,5-6,8H,7,9H2