(2R,3S,4R,5S)-3-(3-chloranyl-2-fluoranyl-phenyl)-4-(4-chlorophenyl)-4-cyano-5-(2,2-dimethylpropyl)-N-(3-imidazol-1-ylpropyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R,3S,4R,5S)-3-(3-chloranyl-2-fluoranyl-phenyl)-4-(4-chlorophenyl)-4-cyano-5-(2,2-dimethylpropyl)-N-(3-imidazol-1-ylpropyl)pyrrolidine-2-carboxamide Openeye Name: (2R,3S,4R,5S)-3-(3-chloro-2-fluoro-phenyl)-4-(4-chlorophenyl)-4-cyano-5-(2,2-dimethylpropyl)-N-(3-imidazol-1-ylpropyl)pyrrolidine-2-carboxamide CAS Name: (2R,3S,4R,5S)-3-(3-chloro-2-fluorophenyl)-4-(4-chlorophenyl)-4-cyano-5-(2,2-dimethylpropyl)-N-[3-(1-imidazolyl)propyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R,3S,4R,5S)-3-(3-chloro-2-fluorophenyl)-4-(4-chlorophenyl)-4-cyano-5-(2,2-dimethylpropyl)-N-(3-imidazol-1-ylpropyl)pyrrolidine-2-carboxamide Traditional Name: (2R,3S,4R,5S)-3-(3-chloro-2-fluoro-phenyl)-4-(4-chlorophenyl)-4-cyano-N-(3-imidazol-1-ylpropyl)-5-neopentyl-pyrrolidine-2-carboxamide Formula: C29H32Cl2FN5O MolecularWeight: 556.501683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1C(C(C(N1)C(=O)NCCCN2C=CN=C2)C3=C(C(=CC=C3)Cl)F)(C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C[C@H]1[C@]([C@H]([C@@H](N1)C(=O)NCCCN2C=CN=C2)C3=C(C(=CC=C3)Cl)F)(C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H32Cl2FN5O/c1-28(2,3)16-23-29(17-33,19-8-10-20(30)11-9-19)24(21-6-4-7-22(31)25(21)32)26(36-23)27(38)35-12-5-14-37-15-13-34-18-37/h4,6-11,13,15,18,23-24,26,36H,5,12,14,16H2,1-3H3,(H,35,38)/t23-,24-,26+,29-/m0/s1