N1-tert-butyl-4-(3-fluorophenyl)-N3-(pyridin-3-ylmethyl)pyrrolidine-1,3-dicarboxamide

Systemtic Name: N1-tert-butyl-4-(3-fluorophenyl)-N3-(pyridin-3-ylmethyl)pyrrolidine-1,3-dicarboxamide Openeye Name: N1-tert-butyl-4-(3-fluorophenyl)-N3-(3-pyridylmethyl)pyrrolidine-1,3-dicarboxamide CAS Name: N1-tert-butyl-4-(3-fluorophenyl)-N3-(3-pyridinylmethyl)pyrrolidine-1,3-dicarboxamide IUPAC Name: 1-N-tert-butyl-4-(3-fluorophenyl)-3-N-(pyridin-3-ylmethyl)pyrrolidine-1,3-dicarboxamide Traditional Name: N-tert-butyl-4-(3-fluorophenyl)-N'-(3-pyridylmethyl)pyrrolidine-1,3-dicarboxamide Formula: C22H27FN4O2 MolecularWeight: 398.473783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CC(C(C1)C(=O)NCC2=CN=CC=C2)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)NC(=O)N1CC(C(C1)C(=O)NCC2=CN=CC=C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H27FN4O2/c1-22(2,3)26-21(29)27-13-18(16-7-4-8-17(23)10-16)19(14-27)20(28)25-12-15-6-5-9-24-11-15/h4-11,18-19H,12-14H2,1-3H3,(H,25,28)(H,26,29)