N-(2-adamantyl)-1-[(2-chlorophenyl)methylsulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-adamantyl)-1-[(2-chlorophenyl)methylsulfonyl]pyrrolidine-2-carboxamide Openeye Name: N-(2-adamantyl)-1-[(2-chlorophenyl)methylsulfonyl]pyrrolidine-2-carboxamide CAS Name: N-(2-adamantyl)-1-[(2-chlorophenyl)methylsulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-adamantyl)-1-[(2-chlorophenyl)methylsulfonyl]pyrrolidine-2-carboxamide Traditional Name: N-(2-adamantyl)-1-(2-chlorobenzyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C22H29ClN2O3S MolecularWeight: 436.99526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2Cl)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2Cl)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H29ClN2O3S/c23-19-5-2-1-4-16(19)13-29(27,28)25-7-3-6-20(25)22(26)24-21-17-9-14-8-15(11-17)12-18(21)10-14/h1-2,4-5,14-15,17-18,20-21H,3,6-13H2,(H,24,26)