3-fluoranyl-N-[[4-(2-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 3-fluoranyl-N-[[4-(2-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 3-fluoro-N-[[4-(2-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 3-fluoro-N-[[4-(2-methoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 3-fluoro-N-[[4-(2-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 3-fluoro-N-[[4-(2-methoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C20H21FN4O2S MolecularWeight: 400.469743

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=CC=C2OC)CNC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=CC=C2OC)CNC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H21FN4O2S/c1-3-11-28-20-24-23-18(25(20)16-9-4-5-10-17(16)27-2)13-22-19(26)14-7-6-8-15(21)12-14/h4-10,12H,3,11,13H2,1-2H3,(H,22,26)