1-[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl 4-methylsulfinylbenzoate

Systemtic Name: 1-[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl 4-methylsulfinylbenzoate Openeye Name: 1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl 4-methylsulfinylbenzoate CAS Name: 4-methylsulfinylbenzoic acid 1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl 4-methylsulfinylbenzoate Traditional Name: 4-methylsulfinylbenzoic acid 1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C19H17FN2O4S MolecularWeight: 388.412683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)C(C)OC(=O)C3=CC=C(C=C3)S(=O)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)C(C)OC(=O)C3=CC=C(C=C3)S(=O)C)F

InChI

InChI=1S/C19H17FN2O4S/c1-11-4-5-14(10-16(11)20)17-21-18(26-22-17)12(2)25-19(23)13-6-8-15(9-7-13)27(3)24/h4-10,12H,1-3H3