2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[[3-(4-chlorophenyl)isoxazol-5-yl]methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[[3-(4-chlorophenyl)-5-isoxazolyl]methylthio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[[3-(4-chlorophenyl)isoxazol-5-yl]methylthio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C21H21ClN2O2S MolecularWeight: 400.92164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSCC2=CC(=NO2)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSCC2=CC(=NO2)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H21ClN2O2S/c1-3-15-6-4-5-14(2)21(15)23-20(25)13-27-12-18-11-19(24-26-18)16-7-9-17(22)10-8-16/h4-11H,3,12-13H2,1-2H3,(H,23,25)