4-bromanyl-N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-[1-[(2-chloro-6-fluoro-phenyl)methyl]-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-[1-[(2-chloro-6-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-[1-[(2-chloro-6-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-[1-(2-chloro-6-fluoro-benzyl)-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide Formula: C13H9BrClFN6O MolecularWeight: 399.605563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=NC(=N2)NC(=O)C3=C(C=NN3)Br)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=NC(=N2)NC(=O)C3=C(C=NN3)Br)F

InChI

InChI=1S/C13H9BrClFN6O/c14-8-4-18-20-11(8)12(23)19-13-17-6-22(21-13)5-7-9(15)2-1-3-10(7)16/h1-4,6H,5H2,(H,18,20)(H,19,21,23)