N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSC4=NN=C(O4)C5=CN=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSC4=NN=C(O4)C5=CN=CC=C5

InChI

InChI=1S/C22H25N5O2S/c23-4-2-6-27(22-10-15-7-16(11-22)9-17(8-15)12-22)19(28)14-30-21-26-25-20(29-21)18-3-1-5-24-13-18/h1,3,5,13,15-17H,2,6-12,14H2