N-[2-(cyanomethylsulfanyl)phenyl]-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]acetamide Formula: C21H26N4OS2 MolecularWeight: 414.58734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)NC2=CC=CC=C2SCC#N)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)NC2=CC=CC=C2SCC#N)C3CCCCC3)C

InChI

InChI=1S/C21H26N4OS2/c1-15-16(2)25(17-8-4-3-5-9-17)21(23-15)28-14-20(26)24-18-10-6-7-11-19(18)27-13-12-22/h6-7,10-11,17H,3-5,8-9,13-14H2,1-2H3,(H,24,26)