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

Systemtic Name: (2S,4S)-4-(2-adamantylamino)-1-[(4-chlorophenyl)methyl]-N-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4S)-4-(2-adamantylamino)-1-[(4-chlorophenyl)methyl]-N-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4S)-4-(2-adamantylamino)-1-[(4-chlorophenyl)methyl]-N-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S)-4-(2-adamantylamino)-1-[(4-chlorophenyl)methyl]-N-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4S)-4-(2-adamantylamino)-1-(4-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=C(C=C2)Cl)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC(C)NC(=O)[C@@H]1C[C@@H](CN1CC2=CC=C(C=C2)Cl)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C25H36ClN3O/c1-15(2)27-25(30)23-12-22(14-29(23)13-16-3-5-21(26)6-4-16)28-24-19-8-17-7-18(10-19)11-20(24)9-17/h3-6,15,17-20,22-24,28H,7-14H2,1-2H3,(H,27,30)/t17?,18?,19?,20?,22-,23-,24?/m0/s1