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

Systemtic Name: 4-fluoranyl-N-[(4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: N-[(5-allylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-4-fluoro-benzamide CAS Name: 4-fluoro-N-[[4-phenyl-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-fluoro-N-[(4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: N-[[5-(allylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]-4-fluoro-benzamide Formula: C19H17FN4OS MolecularWeight: 368.427883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17FN4OS/c1-2-12-26-19-23-22-17(24(19)16-6-4-3-5-7-16)13-21-18(25)14-8-10-15(20)11-9-14/h2-11H,1,12-13H2,(H,21,25)