2-(2,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-phenyl-pyrazole-3-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-phenyl-pyrazole-3-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-phenyl-3-pyrazolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-phenylpyrazole-3-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-(4-fluorobenzyl)-5-phenyl-pyrazole-3-carboxamide Formula: C25H22FN3O MolecularWeight: 399.460083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F)C

InChI

InChI=1S/C25H22FN3O/c1-17-8-13-23(18(2)14-17)29-24(15-22(28-29)20-6-4-3-5-7-20)25(30)27-16-19-9-11-21(26)12-10-19/h3-15H,16H2,1-2H3,(H,27,30)