3-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-5-ethyl-5-methyl-4H-1,2-oxazole

Systemtic Name: 3-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-5-ethyl-5-methyl-4H-1,2-oxazole Openeye Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-5-ethyl-5-methyl-4H-isoxazole CAS Name: 3-[(2,6-difluorophenyl)methylthio]-5-ethyl-5-methyl-4H-isoxazole IUPAC Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-5-ethyl-5-methyl-4H-1,2-oxazole Traditional Name: 3-[(2,6-difluorobenzyl)thio]-5-ethyl-5-methyl-2-isoxazoline Formula: C13H15F2NOS MolecularWeight: 271.326106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=NO1)SCC2=C(C=CC=C2F)F)C

Isomeric SMILES

CCC1(CC(=NO1)SCC2=C(C=CC=C2F)F)C

InChI

InChI=1S/C13H15F2NOS/c1-3-13(2)7-12(16-17-13)18-8-9-10(14)5-4-6-11(9)15/h4-6H,3,7-8H2,1-2H3