(2S)-2-[[(1S)-1-[4-[4-[(1R)-2,2-bis(fluoranyl)-1-oxidanyl-ethyl]phenyl]phenyl]-2,2,2-tris(fluoranyl)ethyl]amino]-N-[(1S)-1-cyano-2-(4-cyano-2-fluoranyl-phenyl)ethyl]-2-cyclopropyl-ethanamide

Systemtic Name: (2S)-2-[[(1S)-1-[4-[4-[(1R)-2,2-bis(fluoranyl)-1-oxidanyl-ethyl]phenyl]phenyl]-2,2,2-tris(fluoranyl)ethyl]amino]-N-[(1S)-1-cyano-2-(4-cyano-2-fluoranyl-phenyl)ethyl]-2-cyclopropyl-ethanamide Openeye Name: (2S)-N-[(1S)-1-cyano-2-(4-cyano-2-fluoro-phenyl)ethyl]-2-cyclopropyl-2-[[(1S)-1-[4-[4-[(1R)-2,2-difluoro-1-hydroxy-ethyl]phenyl]phenyl]-2,2,2-trifluoro-ethyl]amino]acetamide CAS Name: (2S)-N-[(1S)-1-cyano-2-(4-cyano-2-fluorophenyl)ethyl]-2-cyclopropyl-2-[[(1S)-1-[4-[4-[(1R)-2,2-difluoro-1-hydroxyethyl]phenyl]phenyl]-2,2,2-trifluoroethyl]amino]acetamide IUPAC Name: (2S)-N-[(1S)-1-cyano-2-(4-cyano-2-fluorophenyl)ethyl]-2-cyclopropyl-2-[[(1S)-1-[4-[4-[(1R)-2,2-difluoro-1-hydroxyethyl]phenyl]phenyl]-2,2,2-trifluoroethyl]amino]acetamide Traditional Name: (2S)-N-[(1S)-1-cyano-2-(4-cyano-2-fluoro-phenyl)ethyl]-2-cyclopropyl-2-[[(1S)-1-[4-[4-[(1R)-2,2-difluoro-1-hydroxy-ethyl]phenyl]phenyl]-2,2,2-trifluoro-ethyl]amino]acetamide Formula: C31H26F6N4O2 MolecularWeight: 600.554159

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C(=O)NC(CC2=C(C=C(C=C2)C#N)F)C#N)NC(C3=CC=C(C=C3)C4=CC=C(C=C4)C(C(F)F)O)C(F)(F)F

Isomeric SMILES

C1CC1[C@@H](C(=O)N[C@@H](CC2=C(C=C(C=C2)C#N)F)C#N)N[C@@H](C3=CC=C(C=C3)C4=CC=C(C=C4)[C@H](C(F)F)O)C(F)(F)F

InChI

InChI=1S/C31H26F6N4O2/c32-25-13-17(15-38)1-2-23(25)14-24(16-39)40-30(43)26(20-7-8-20)41-28(31(35,36)37)22-11-5-19(6-12-22)18-3-9-21(10-4-18)27(42)29(33)34/h1-6,9-13,20,24,26-29,41-42H,7-8,14H2,(H,40,43)/t24-,26-,27+,28-/m0/s1