N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3,4-dimethoxy-benzamide Formula: C25H22FN3O3 MolecularWeight: 431.458883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CN(N=C2C3=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)25(30)27-15-19-16-29(21-6-4-3-5-7-21)28-24(19)17-8-11-20(26)12-9-17/h3-14,16H,15H2,1-2H3,(H,27,30)