N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-(2,3,5,6-tetramethylphenyl)sulfanyl-acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[(2,3,5,6-tetramethylphenyl)thio]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-(2,3,5,6-tetramethylphenyl)sulfanylacetamide Traditional Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[(2,3,5,6-tetramethylphenyl)thio]acetamide Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC(=O)NC(C)(C#N)C(C)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC(=O)N[C@](C)(C#N)C(C)C)C)C

InChI

InChI=1S/C18H26N2OS/c1-11(2)18(7,10-19)20-16(21)9-22-17-14(5)12(3)8-13(4)15(17)6/h8,11H,9H2,1-7H3,(H,20,21)/t18-/m1/s1