(2S,4R)-4-(2-adamantylamino)-1-[(2-chlorophenyl)methyl]-N-propan-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-(2-adamantylamino)-1-[(2-chlorophenyl)methyl]-N-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-4-(2-adamantylamino)-1-[(2-chlorophenyl)methyl]-N-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-(2-adamantylamino)-1-[(2-chlorophenyl)methyl]-N-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-4-(2-adamantylamino)-1-[(2-chlorophenyl)methyl]-N-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-4-(2-adamantylamino)-1-(2-chlorobenzyl)-N-isopropyl-pyrrolidine-2-carboxamide Formula: C25H36ClN3O MolecularWeight: 430.02584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC(CN1CC2=CC=CC=C2Cl)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC(C)NC(=O)[C@@H]1C[C@H](CN1CC2=CC=CC=C2Cl)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C25H36ClN3O/c1-15(2)27-25(30)23-12-21(14-29(23)13-18-5-3-4-6-22(18)26)28-24-19-8-16-7-17(10-19)11-20(24)9-16/h3-6,15-17,19-21,23-24,28H,7-14H2,1-2H3,(H,27,30)/t16?,17?,19?,20?,21-,23+,24?/m1/s1