5-(4-fluorophenyl)-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-fluorophenyl)-N-[[2-(isopropoxymethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide CAS Name: 5-(4-fluorophenyl)-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide IUPAC Name: 5-(4-fluorophenyl)-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-[2-(isopropoxymethyl)benzyl]-1H-pyrazole-4-carboxamide Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=CC=C1CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)OCC1=CC=CC=C1CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O2/c1-14(2)27-13-17-6-4-3-5-16(17)11-23-21(26)19-12-24-25-20(19)15-7-9-18(22)10-8-15/h3-10,12,14H,11,13H2,1-2H3,(H,23,26)(H,24,25)