(2S)-N-(1-cyanocyclopropyl)-5-cyclopropyl-5,5-bis(fluoranyl)-2-[[(1S)-2,2,2-tris(fluoranyl)-1-(4-fluorophenyl)ethyl]amino]pentanamide

Systemtic Name: (2S)-N-(1-cyanocyclopropyl)-5-cyclopropyl-5,5-bis(fluoranyl)-2-[[(1S)-2,2,2-tris(fluoranyl)-1-(4-fluorophenyl)ethyl]amino]pentanamide Openeye Name: (2S)-N-(1-cyanocyclopropyl)-5-cyclopropyl-5,5-difluoro-2-[[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino]pentanamide CAS Name: (2S)-N-(1-cyanocyclopropyl)-5-cyclopropyl-5,5-difluoro-2-[[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino]pentanamide IUPAC Name: (2S)-N-(1-cyanocyclopropyl)-5-cyclopropyl-5,5-difluoro-2-[[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino]pentanamide Traditional Name: (2S)-N-(1-cyanocyclopropyl)-5-cyclopropyl-5,5-difluoro-2-[[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino]valeramide Formula: C20H21F6N3O MolecularWeight: 433.390659

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(CCC(C(=O)NC2(CC2)C#N)NC(C3=CC=C(C=C3)F)C(F)(F)F)(F)F

Isomeric SMILES

C1CC1C(CC[C@@H](C(=O)NC2(CC2)C#N)N[C@@H](C3=CC=C(C=C3)F)C(F)(F)F)(F)F

InChI

InChI=1S/C20H21F6N3O/c21-14-5-1-12(2-6-14)16(20(24,25)26)28-15(7-8-19(22,23)13-3-4-13)17(30)29-18(11-27)9-10-18/h1-2,5-6,13,15-16,28H,3-4,7-10H2,(H,29,30)/t15-,16-/m0/s1