N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-methoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(4-methoxyphenyl)thio]acetamide Formula: C22H28N2O2S MolecularWeight: 384.53492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)N(CCC#N)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)N(CCC#N)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28N2O2S/c1-26-19-3-5-20(6-4-19)27-15-21(25)24(8-2-7-23)22-12-16-9-17(13-22)11-18(10-16)14-22/h3-6,16-18H,2,8-15H2,1H3