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

Systemtic Name: N-[4-[5-(4-bromophenyl)-1,2,3-triazol-1-yl]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[4-[5-(4-bromophenyl)triazol-1-yl]phenyl]-3-fluoro-benzamide CAS Name: N-[4-[5-(4-bromophenyl)-1-triazolyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[4-[5-(4-bromophenyl)triazol-1-yl]phenyl]-3-fluorobenzamide Traditional Name: N-[4-[5-(4-bromophenyl)triazol-1-yl]phenyl]-3-fluoro-benzamide Formula: C21H14BrFN4O MolecularWeight: 437.264463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(=O)NC2=CC=C(C=C2)N3C(=CN=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC(=CC(=C1)F)C(=O)NC2=CC=C(C=C2)N3C(=CN=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H14BrFN4O/c22-16-6-4-14(5-7-16)20-13-24-26-27(20)19-10-8-18(9-11-19)25-21(28)15-2-1-3-17(23)12-15/h1-13H,(H,25,28)