N-[[4-ethyl-5-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-fluoranyl-benzamide

Systemtic Name: N-[[4-ethyl-5-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-fluoranyl-benzamide Openeye Name: N-[[4-ethyl-5-[2-oxo-2-(1-phenylethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-fluoro-benzamide CAS Name: N-[[4-ethyl-5-[[2-oxo-2-(1-phenylethylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-4-fluorobenzamide IUPAC Name: N-[[4-ethyl-5-[2-oxo-2-(1-phenylethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-fluorobenzamide Traditional Name: N-[[4-ethyl-5-[[2-keto-2-(1-phenylethylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-4-fluoro-benzamide Formula: C22H24FN5O2S MolecularWeight: 441.521663

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(C)C2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(C)C2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN5O2S/c1-3-28-19(13-24-21(30)17-9-11-18(23)12-10-17)26-27-22(28)31-14-20(29)25-15(2)16-7-5-4-6-8-16/h4-12,15H,3,13-14H2,1-2H3,(H,24,30)(H,25,29)