N-(3-cyanophenyl)-4-(2-hydroxyethylsulfanyl)butanamide

Systemtic Name: N-(3-cyanophenyl)-4-(2-hydroxyethylsulfanyl)butanamide Openeye Name: N-(3-cyanophenyl)-4-(2-hydroxyethylsulfanyl)butanamide CAS Name: N-(3-cyanophenyl)-4-(2-hydroxyethylthio)butanamide IUPAC Name: N-(3-cyanophenyl)-4-(2-hydroxyethylsulfanyl)butanamide Traditional Name: N-(3-cyanophenyl)-4-(2-hydroxyethylthio)butyramide Formula: C13H16N2O2S MolecularWeight: 264.34334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCSCCO)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCSCCO)C#N

InChI

InChI=1S/C13H16N2O2S/c14-10-11-3-1-4-12(9-11)15-13(17)5-2-7-18-8-6-16/h1,3-4,9,16H,2,5-8H2,(H,15,17)