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

Systemtic Name: N-[[3-(3-fluoranyl-4-thiomorpholin-4-yl-phenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-(3-fluoro-4-thiomorpholino-phenyl)-4,5-dihydroisoxazol-5-yl]methyl]thioacetamide CAS Name: N-[[3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-4,5-dihydroisoxazol-5-yl]methyl]ethanethioamide IUPAC Name: N-[[3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanethioamide Traditional Name: N-[[3-(3-fluoro-4-thiomorpholino-phenyl)-2-isoxazolin-5-yl]methyl]thioacetamide Formula: C16H20FN3OS2 MolecularWeight: 353.477903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CC(=NO1)C2=CC(=C(C=C2)N3CCSCC3)F

Isomeric SMILES

CC(=S)NCC1CC(=NO1)C2=CC(=C(C=C2)N3CCSCC3)F

InChI

InChI=1S/C16H20FN3OS2/c1-11(22)18-10-13-9-15(19-21-13)12-2-3-16(14(17)8-12)20-4-6-23-7-5-20/h2-3,8,13H,4-7,9-10H2,1H3,(H,18,22)