N-(1-adamantyl)-N-(2-cyanoethyl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: N-(1-adamantyl)-2-benzylsulfanyl-N-(2-cyanoethyl)acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(phenylmethylthio)acetamide IUPAC Name: N-(1-adamantyl)-2-benzylsulfanyl-N-(2-cyanoethyl)acetamide Traditional Name: N-(1-adamantyl)-2-(benzylthio)-N-(2-cyanoethyl)acetamide Formula: C22H28N2OS MolecularWeight: 368.53552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C22H28N2OS/c23-7-4-8-24(21(25)16-26-15-17-5-2-1-3-6-17)22-12-18-9-19(13-22)11-20(10-18)14-22/h1-3,5-6,18-20H,4,8-16H2