(2S)-1-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[[3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]pyrrolidine-2-carboxamide Formula: C22H23FN4O2 MolecularWeight: 394.442023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C=C2CN3CCCC3C(=O)N)C4=CC=CC=C4)F

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C=C2CN3CCC[C@H]3C(=O)N)C4=CC=CC=C4)F

InChI

InChI=1S/C22H23FN4O2/c1-29-17-9-10-18(19(23)12-17)21-15(13-26-11-5-8-20(26)22(24)28)14-27(25-21)16-6-3-2-4-7-16/h2-4,6-7,9-10,12,14,20H,5,8,11,13H2,1H3,(H2,24,28)/t20-/m0/s1