(2S,4R)-4-(2-adamantylamino)-1-(phenylmethyl)-N-propan-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-(2-adamantylamino)-1-(phenylmethyl)-N-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-4-(2-adamantylamino)-1-benzyl-N-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-(2-adamantylamino)-1-(phenylmethyl)-N-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-4-(2-adamantylamino)-1-benzyl-N-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-4-(2-adamantylamino)-1-benzyl-N-isopropyl-pyrrolidine-2-carboxamide Formula: C25H37N3O MolecularWeight: 395.58078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC(CN1CC2=CC=CC=C2)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

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

InChI

InChI=1S/C25H37N3O/c1-16(2)26-25(29)23-13-22(15-28(23)14-17-6-4-3-5-7-17)27-24-20-9-18-8-19(11-20)12-21(24)10-18/h3-7,16,18-24,27H,8-15H2,1-2H3,(H,26,29)/t18?,19?,20?,21?,22-,23+,24?/m1/s1