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

Systemtic Name: 2-fluoranyl-N-[3-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]benzamide Openeye Name: N-[3-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[3-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]phenyl]benzamide IUPAC Name: N-[3-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]-2-fluorobenzamide Traditional Name: N-[3-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]-2-fluoro-benzamide Formula: C23H19FN4OS MolecularWeight: 418.486563

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H19FN4OS/c1-28-21(26-27-23(28)30-15-16-8-3-2-4-9-16)17-10-7-11-18(14-17)25-22(29)19-12-5-6-13-20(19)24/h2-14H,15H2,1H3,(H,25,29)