N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3-oxidanyl-1-adamantyl)ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3-oxidanyl-1-adamantyl)ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3-hydroxy-1-adamantyl)acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-(3-hydroxy-1-adamantyl)acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3-hydroxy-1-adamantyl)acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(3-hydroxy-1-adamantyl)acetamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)CC(=O)NCCSCC4=CC=CC=C4C#N

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)CC(=O)NCCSCC4=CC=CC=C4C#N

InChI

InChI=1S/C22H28N2O2S/c23-13-18-3-1-2-4-19(18)14-27-6-5-24-20(25)12-21-8-16-7-17(9-21)11-22(26,10-16)15-21/h1-4,16-17,26H,5-12,14-15H2,(H,24,25)