N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(3-chloranylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(3-chloranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(3-chlorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-1-[(3-chlorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(3-chlorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(3-chlorophenoxy)methyl]pyrazole-3-carboxamide Formula: C21H17BrClN5O2 MolecularWeight: 486.74898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)COC3=CC(=CC=C3)Cl)CN4C=C(C=N4)Br

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)COC3=CC(=CC=C3)Cl)CN4C=C(C=N4)Br

InChI

InChI=1S/C21H17BrClN5O2/c22-16-11-24-28(13-16)12-15-3-1-5-18(9-15)25-21(29)20-7-8-27(26-20)14-30-19-6-2-4-17(23)10-19/h1-11,13H,12,14H2,(H,25,29)