1-(4-bromophenyl)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-N-[(4-fluoro-3-methyl-phenyl)methyl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-N-[(4-fluoro-3-methylphenyl)methyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-[(4-fluoro-3-methylphenyl)methyl]-5-methylpyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-N-(4-fluoro-3-methyl-benzyl)-5-methyl-pyrazole-4-carboxamide Formula: C19H17BrFN3O MolecularWeight: 402.260183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Br)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Br)C)F

InChI

InChI=1S/C19H17BrFN3O/c1-12-9-14(3-8-18(12)21)10-22-19(25)17-11-23-24(13(17)2)16-6-4-15(20)5-7-16/h3-9,11H,10H2,1-2H3,(H,22,25)