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

Systemtic Name: 3-[3-[2-(4-dimethylaminophenyl)phenyl]-4-fluoranyl-phenyl]-1H-1,2,4-triazole-5-carboxamide Openeye Name: 3-[3-[2-(4-dimethylaminophenyl)phenyl]-4-fluoro-phenyl]-1H-1,2,4-triazole-5-carboxamide CAS Name: 3-[3-[2-(4-dimethylaminophenyl)phenyl]-4-fluorophenyl]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: 3-[3-[2-(4-dimethylaminophenyl)phenyl]-4-fluorophenyl]-1H-1,2,4-triazole-5-carboxamide Traditional Name: 3-[3-[2-(4-dimethylaminophenyl)phenyl]-4-fluoro-phenyl]-1H-1,2,4-triazole-5-carboxamide Formula: C23H20FN5O MolecularWeight: 401.436203

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CC=CC=C2C3=C(C=CC(=C3)C4=NNC(=N4)C(=O)N)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CC=CC=C2C3=C(C=CC(=C3)C4=NNC(=N4)C(=O)N)F

InChI

InChI=1S/C23H20FN5O/c1-29(2)16-10-7-14(8-11-16)17-5-3-4-6-18(17)19-13-15(9-12-20(19)24)22-26-23(21(25)30)28-27-22/h3-13H,1-2H3,(H2,25,30)(H,26,27,28)