N-[4-(cyanomethyl)phenyl]-2-(2,5-dimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-(2,5-dimethylphenyl)sulfanyl-ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(2,5-dimethylphenyl)sulfanyl-acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-[(2,5-dimethylphenyl)thio]acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(2,5-dimethylphenyl)sulfanylacetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-[(2,5-dimethylphenyl)thio]acetamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)NC2=CC=C(C=C2)CC#N

InChI

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