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

Systemtic Name: N-[3-[3-fluoranyl-4-(3-methanoylpyrrol-1-yl)phenyl]-4,5-dihydro-1,2-oxazol-5-yl]-N-methyl-ethanethioamide Openeye Name: N-[3-[3-fluoro-4-(3-formylpyrrol-1-yl)phenyl]-4,5-dihydroisoxazol-5-yl]-N-methyl-thioacetamide CAS Name: N-[3-[3-fluoro-4-(3-formyl-1-pyrrolyl)phenyl]-4,5-dihydroisoxazol-5-yl]-N-methylethanethioamide IUPAC Name: N-[3-[3-fluoro-4-(3-formylpyrrol-1-yl)phenyl]-4,5-dihydro-1,2-oxazol-5-yl]-N-methylethanethioamide Traditional Name: N-[3-[3-fluoro-4-(3-formylpyrrol-1-yl)phenyl]-2-isoxazolin-5-yl]-N-methyl-thioacetamide Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)N(C)C1CC(=NO1)C2=CC(=C(C=C2)N3C=CC(=C3)C=O)F

Isomeric SMILES

CC(=S)N(C)C1CC(=NO1)C2=CC(=C(C=C2)N3C=CC(=C3)C=O)F

InChI

InChI=1S/C17H16FN3O2S/c1-11(24)20(2)17-8-15(19-23-17)13-3-4-16(14(18)7-13)21-6-5-12(9-21)10-22/h3-7,9-10,17H,8H2,1-2H3