2-(cyanomethylsulfanyl)-N-(3,5-dimethylphenyl)ethanamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-(3,5-dimethylphenyl)ethanamide Openeye Name: 2-(cyanomethylsulfanyl)-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-(cyanomethylthio)-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-(cyanomethylthio)-N-(3,5-dimethylphenyl)acetamide Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSCC#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSCC#N)C

InChI

InChI=1S/C12H14N2OS/c1-9-5-10(2)7-11(6-9)14-12(15)8-16-4-3-13/h5-7H,4,8H2,1-2H3,(H,14,15)