N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(6,7-dimethylbenzofuran-3-yl)acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-(6,7-dimethyl-3-benzofuranyl)acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(6,7-dimethyl-1-benzofuran-3-yl)acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(6,7-dimethylbenzofuran-3-yl)acetamide Formula: C22H22N2O2S MolecularWeight: 378.48728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NCCSCC3=CC=CC=C3C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NCCSCC3=CC=CC=C3C#N)C

InChI

InChI=1S/C22H22N2O2S/c1-15-7-8-20-19(13-26-22(20)16(15)2)11-21(25)24-9-10-27-14-18-6-4-3-5-17(18)12-23/h3-8,13H,9-11,14H2,1-2H3,(H,24,25)