2-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-5-fluoranyl-benzamide

Systemtic Name: 2-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-5-fluoranyl-benzamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-bromo-5-fluoro-benzamide CAS Name: 2-bromo-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-5-fluorobenzamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2-bromo-5-fluorobenzamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-bromo-5-fluoro-benzamide Formula: C20H19BrFN3O MolecularWeight: 416.286763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=C(C=CC(=C3)F)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=C(C=CC(=C3)F)Br

InChI

InChI=1S/C20H19BrFN3O/c1-13-18(11-23-20(26)17-10-16(22)8-9-19(17)21)14(2)25(24-13)12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,23,26)