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

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-1-(1-pyrazolylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C18H16BrN7O MolecularWeight: 426.26994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)CN3C=CC=N3)CN4C=C(C=N4)Br

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)CN3C=CC=N3)CN4C=C(C=N4)Br

InChI

InChI=1S/C18H16BrN7O/c19-15-10-21-26(12-15)11-14-3-1-4-16(9-14)22-18(27)17-5-8-25(23-17)13-24-7-2-6-20-24/h1-10,12H,11,13H2,(H,22,27)