2-[[5-[(2-fluoranylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-propanamide

Systemtic Name: 2-[[5-[(2-fluoranylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-propanamide Openeye Name: 2-[[5-[(2-fluorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-propanamide CAS Name: 2-[[5-[(2-fluorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-N-methylpropanamide IUPAC Name: 2-[[5-[(2-fluorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-methylpropanamide Traditional Name: 2-[[5-[(2-fluorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-N-methyl-propionamide Formula: C19H19FN4O2S MolecularWeight: 386.443163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)SC1=NN=C(N1C2=CC=CC=C2)COC3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)NC)SC1=NN=C(N1C2=CC=CC=C2)COC3=CC=CC=C3F

InChI

InChI=1S/C19H19FN4O2S/c1-13(18(25)21-2)27-19-23-22-17(24(19)14-8-4-3-5-9-14)12-26-16-11-7-6-10-15(16)20/h3-11,13H,12H2,1-2H3,(H,21,25)