[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylethanoate

Systemtic Name: [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylethanoate Openeye Name: [5-(2-fluorophenyl)isoxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylacetate CAS Name: 2-(2-pyrimidinylthio)acetic acid [5-(2-fluorophenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylacetate Traditional Name: 2-(2-pyrimidylthio)acetic acid [5-(2-fluorophenyl)isoxazol-3-yl]methyl ester Formula: C16H12FN3O3S MolecularWeight: 345.348183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=NO2)COC(=O)CSC3=NC=CC=N3)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=NO2)COC(=O)CSC3=NC=CC=N3)F

InChI

InChI=1S/C16H12FN3O3S/c17-13-5-2-1-4-12(13)14-8-11(20-23-14)9-22-15(21)10-24-16-18-6-3-7-19-16/h1-8H,9-10H2