2-(cyanomethylsulfanyl)-N-[(2,4-dimethylphenyl)methyl]ethanamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-[(2,4-dimethylphenyl)methyl]ethanamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[(2,4-dimethylphenyl)methyl]acetamide CAS Name: 2-(cyanomethylthio)-N-[(2,4-dimethylphenyl)methyl]acetamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-[(2,4-dimethylphenyl)methyl]acetamide Traditional Name: 2-(cyanomethylthio)-N-(2,4-dimethylbenzyl)acetamide Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2OS/c1-10-3-4-12(11(2)7-10)8-15-13(16)9-17-6-5-14/h3-4,7H,6,8-9H2,1-2H3,(H,15,16)