[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylethanoate

Systemtic Name: [5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylethanoate Openeye Name: [5-(4-fluorophenyl)isoxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylacetate CAS Name: 2-(2-pyrimidinylthio)acetic acid [5-(4-fluorophenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl 2-pyrimidin-2-ylsulfanylacetate Traditional Name: 2-(2-pyrimidylthio)acetic acid [5-(4-fluorophenyl)isoxazol-3-yl]methyl ester Formula: C16H12FN3O3S MolecularWeight: 345.348183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)OCC2=NOC(=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)OCC2=NOC(=C2)C3=CC=C(C=C3)F

InChI

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