3-[3-[2-[2,3,4-tris(fluoranyl)phenyl]phenyl]phenyl]-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: 3-[3-[2-[2,3,4-tris(fluoranyl)phenyl]phenyl]phenyl]-1H-1,2,4-triazole-5-carboxamide Openeye Name: 3-[3-[2-(2,3,4-trifluorophenyl)phenyl]phenyl]-1H-1,2,4-triazole-5-carboxamide CAS Name: 3-[3-[2-(2,3,4-trifluorophenyl)phenyl]phenyl]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: 3-[3-[2-(2,3,4-trifluorophenyl)phenyl]phenyl]-1H-1,2,4-triazole-5-carboxamide Traditional Name: 3-[3-[2-(2,3,4-trifluorophenyl)phenyl]phenyl]-1H-1,2,4-triazole-5-carboxamide Formula: C21H13F3N4O MolecularWeight: 394.34933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=CC=C2)C3=NNC(=N3)C(=O)N)C4=C(C(=C(C=C4)F)F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=CC=C2)C3=NNC(=N3)C(=O)N)C4=C(C(=C(C=C4)F)F)F

InChI

InChI=1S/C21H13F3N4O/c22-16-9-8-15(17(23)18(16)24)14-7-2-1-6-13(14)11-4-3-5-12(10-11)20-26-21(19(25)29)28-27-20/h1-10H,(H2,25,29)(H,26,27,28)