(2R)-N-[3-(1-adamantylcarbamoyl)phenyl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-[3-(1-adamantylcarbamoyl)phenyl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: (2R)-N-[3-(1-adamantylcarbamoyl)phenyl]-1-(benzenesulfonyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-[3-[(1-adamantylamino)-oxomethyl]phenyl]-1-(benzenesulfonyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-[3-(1-adamantylcarbamoyl)phenyl]-1-(benzenesulfonyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-[3-(1-adamantylcarbamoyl)phenyl]-1-besyl-pyrrolidine-2-carboxamide Formula: C28H33N3O4S MolecularWeight: 507.64432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C[C@@H](N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H33N3O4S/c32-26(30-28-16-19-12-20(17-28)14-21(13-19)18-28)22-6-4-7-23(15-22)29-27(33)25-10-5-11-31(25)36(34,35)24-8-2-1-3-9-24/h1-4,6-9,15,19-21,25H,5,10-14,16-18H2,(H,29,33)(H,30,32)/t19?,20?,21?,25-,28?/m1/s1