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

Systemtic Name: [(1S)-1-cyanoethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: [(1S)-1-cyanoethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid [(1S)-1-cyanoethyl] ester IUPAC Name: [(1S)-1-cyanoethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid [(1S)-1-cyanoethyl] ester Formula: C14H12FN3O2S MolecularWeight: 305.327383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CSC1=NC=CN1C2=CC(=CC=C2)F

Isomeric SMILES

C[C@@H](C#N)OC(=O)CSC1=NC=CN1C2=CC(=CC=C2)F

InChI

InChI=1S/C14H12FN3O2S/c1-10(8-16)20-13(19)9-21-14-17-5-6-18(14)12-4-2-3-11(15)7-12/h2-7,10H,9H2,1H3/t10-/m0/s1