N5-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C21H24FN5O2 MolecularWeight: 397.445963

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=NN(C(C1)C(=O)N)C2=CC=CC=C2)C3=CC(=CC=C3)F

Isomeric SMILES

CN(C)C(CNC(=O)C1=NN(C(C1)C(=O)N)C2=CC=CC=C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN5O2/c1-26(2)19(14-7-6-8-15(22)11-14)13-24-21(29)17-12-18(20(23)28)27(25-17)16-9-4-3-5-10-16/h3-11,18-19H,12-13H2,1-2H3,(H2,23,28)(H,24,29)