N-[3-(2,5-dimethoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-(2,5-dimethoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[3-(2,5-dimethoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-4-fluoro-benzamide CAS Name: N-[3-(2,5-dimethoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-4-fluorobenzamide IUPAC Name: N-[3-(2,5-dimethoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-4-fluorobenzamide Traditional Name: N-[3-(2,5-dimethoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-4-fluoro-benzamide Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1)C2=C(C=CC(=C2)OC)OC)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=C(C(=NN1)C2=C(C=CC(=C2)OC)OC)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O3/c1-4-5-17-20(23-21(26)13-6-8-14(22)9-7-13)19(25-24-17)16-12-15(27-2)10-11-18(16)28-3/h6-12H,4-5H2,1-3H3,(H,23,26)(H,24,25)