4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-1-phenylpyrazole-3-carboxamide Traditional Name: 4-(3,4-dimethoxyphenyl)-N-(4-fluorobenzyl)-1-phenyl-pyrazole-3-carboxamide Formula: C25H22FN3O3 MolecularWeight: 431.458883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NCC3=CC=C(C=C3)F)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NCC3=CC=C(C=C3)F)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H22FN3O3/c1-31-22-13-10-18(14-23(22)32-2)21-16-29(20-6-4-3-5-7-20)28-24(21)25(30)27-15-17-8-11-19(26)12-9-17/h3-14,16H,15H2,1-2H3,(H,27,30)