N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-fluoro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-fluoro-4-methyl-phenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C22H22FN5O2 MolecularWeight: 407.440783

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3CC(=O)N(C3)C4=C(C=C(C=C4)C)F

Isomeric SMILES

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3CC(=O)N(C3)C4=C(C=C(C=C4)C)F

InChI

InChI=1S/C22H22FN5O2/c1-3-27-13-24-26-21(27)15-5-4-6-17(10-15)25-22(30)16-11-20(29)28(12-16)19-8-7-14(2)9-18(19)23/h4-10,13,16H,3,11-12H2,1-2H3,(H,25,30)