2-[(3-cyanophenyl)methylsulfanyl]-N-(2,4-dimethylphenyl)ethanamide

Systemtic Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-(2,4-dimethylphenyl)ethanamide Openeye Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-(2,4-dimethylphenyl)acetamide CAS Name: 2-[(3-cyanophenyl)methylthio]-N-(2,4-dimethylphenyl)acetamide IUPAC Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-(2,4-dimethylphenyl)acetamide Traditional Name: 2-[(3-cyanobenzyl)thio]-N-(2,4-dimethylphenyl)acetamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC2=CC=CC(=C2)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C18H18N2OS/c1-13-6-7-17(14(2)8-13)20-18(21)12-22-11-16-5-3-4-15(9-16)10-19/h3-9H,11-12H2,1-2H3,(H,20,21)