2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(2-pyridylmethyl)acetamide CAS Name: 2-[(3,5-dimethylphenyl)methylthio]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[(3,5-dimethylbenzyl)thio]-N-(2-pyridylmethyl)acetamide Formula: C17H20N2OS MolecularWeight: 300.4185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSCC(=O)NCC2=CC=CC=N2)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSCC(=O)NCC2=CC=CC=N2)C

InChI

InChI=1S/C17H20N2OS/c1-13-7-14(2)9-15(8-13)11-21-12-17(20)19-10-16-5-3-4-6-18-16/h3-9H,10-12H2,1-2H3,(H,19,20)