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

Systemtic Name: N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-2-fluoranyl-benzamide Openeye Name: N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-2-fluoro-benzamide CAS Name: N-[[5-(ethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide IUPAC Name: N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-2-fluorobenzamide Traditional Name: N-[[5-(ethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-fluoro-benzamide Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H17FN4OS/c1-2-25-18-22-21-16(23(18)13-8-4-3-5-9-13)12-20-17(24)14-10-6-7-11-15(14)19/h3-11H,2,12H2,1H3,(H,20,24)