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

Systemtic Name: N-[[4-(3-chlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-fluoranyl-benzamide Openeye Name: N-[[4-(3-chlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-fluoro-benzamide CAS Name: N-[[4-(3-chlorophenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide IUPAC Name: N-[[4-(3-chlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide Traditional Name: N-[[4-(3-chlorophenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]-3-fluoro-benzamide Formula: C19H18ClFN4OS MolecularWeight: 404.888823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC(=CC=C2)Cl)CNC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC(=CC=C2)Cl)CNC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H18ClFN4OS/c1-2-9-27-19-24-23-17(25(19)16-8-4-6-14(20)11-16)12-22-18(26)13-5-3-7-15(21)10-13/h3-8,10-11H,2,9,12H2,1H3,(H,22,26)