N-(3-pyrrolidin-1-ylcarbonylphenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-pyrrolidin-1-ylcarbonylphenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-(pyrrolidine-1-carbonyl)phenyl]-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide CAS Name: N-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxamide IUPAC Name: N-[3-(pyrrolidine-1-carbonyl)phenyl]-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Traditional Name: N-[3-(pyrrolidine-1-carbonyl)phenyl]-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Formula: C21H18F3N5O2 MolecularWeight: 429.39513

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H18F3N5O2/c22-21(23,24)16-8-1-2-9-18(16)29-13-17(26-27-29)19(30)25-15-7-5-6-14(12-15)20(31)28-10-3-4-11-28/h1-2,5-9,12-13H,3-4,10-11H2,(H,25,30)