N-(3-cyano-4-pyrrolidin-1-yl-phenyl)-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-(3-cyano-4-pyrrolidin-1-yl-phenyl)-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide Openeye Name: N-(3-cyano-4-pyrrolidin-1-yl-phenyl)-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-(1-pyrrolidinyl)phenyl]-1-(4-fluorophenyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-(3-cyano-4-pyrrolidin-1-ylphenyl)-1-(4-fluorophenyl)-5-methylpyrazole-4-carboxamide Traditional Name: N-(3-cyano-4-pyrrolidino-phenyl)-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C22H20FN5O MolecularWeight: 389.425503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)N4CCCC4)C#N

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)N4CCCC4)C#N

InChI

InChI=1S/C22H20FN5O/c1-15-20(14-25-28(15)19-7-4-17(23)5-8-19)22(29)26-18-6-9-21(16(12-18)13-24)27-10-2-3-11-27/h4-9,12,14H,2-3,10-11H2,1H3,(H,26,29)