(3-fluoranyl-4-methoxy-phenyl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-[(5-methylisoxazol-3-yl)methylsulfanyl]benzoate CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]benzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoate Traditional Name: 2-[(5-methylisoxazol-3-yl)methylthio]benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C20H18FNO4S MolecularWeight: 387.424623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)OCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)OCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H18FNO4S/c1-13-9-15(22-26-13)12-27-19-6-4-3-5-16(19)20(23)25-11-14-7-8-18(24-2)17(21)10-14/h3-10H,11-12H2,1-2H3