N-[[(5R)-3-[3,5-bis(fluoranyl)-4-imidazol-1-yl-phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanethioamide

Systemtic Name: N-[[(5R)-3-[3,5-bis(fluoranyl)-4-imidazol-1-yl-phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanethioamide Openeye Name: N-[[(5R)-3-(3,5-difluoro-4-imidazol-1-yl-phenyl)-4,5-dihydroisoxazol-5-yl]methyl]thioacetamide CAS Name: N-[[(5R)-3-[3,5-difluoro-4-(1-imidazolyl)phenyl]-4,5-dihydroisoxazol-5-yl]methyl]ethanethioamide IUPAC Name: N-[[(5R)-3-(3,5-difluoro-4-imidazol-1-ylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanethioamide Traditional Name: N-[[(5R)-3-(3,5-difluoro-4-imidazol-1-yl-phenyl)-2-isoxazolin-5-yl]methyl]thioacetamide Formula: C15H14F2N4OS MolecularWeight: 336.359666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CC(=NO1)C2=CC(=C(C(=C2)F)N3C=CN=C3)F

Isomeric SMILES

CC(=S)NC[C@H]1CC(=NO1)C2=CC(=C(C(=C2)F)N3C=CN=C3)F

InChI

InChI=1S/C15H14F2N4OS/c1-9(23)19-7-11-6-14(20-22-11)10-4-12(16)15(13(17)5-10)21-3-2-18-8-21/h2-5,8,11H,6-7H2,1H3,(H,19,23)/t11-/m1/s1