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

Systemtic Name: 4-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide Openeye Name: 4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide CAS Name: 4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[(4-fluorophenyl)methyl]benzamide IUPAC Name: 4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide Traditional Name: 4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-fluorobenzyl)benzamide Formula: C20H19BrFN3O MolecularWeight: 416.286763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)F)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)F)C)Br

InChI

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