N-(2-cyano-3-methyl-butan-2-yl)-2-[1-(4-methylphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-[1-(4-methylphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[5-phenyl-1-(p-tolyl)imidazol-2-yl]sulfanyl-propanamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[[1-(4-methylphenyl)-5-phenyl-2-imidazolyl]thio]propanamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-[1-(4-methylphenyl)-5-phenylimidazol-2-yl]sulfanylpropanamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[[5-phenyl-1-(p-tolyl)imidazol-2-yl]thio]propionamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CN=C2SC(C)C(=O)NC(C)(C#N)C(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CN=C2SC(C)C(=O)NC(C)(C#N)C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C25H28N4OS/c1-17(2)25(5,16-26)28-23(30)19(4)31-24-27-15-22(20-9-7-6-8-10-20)29(24)21-13-11-18(3)12-14-21/h6-15,17,19H,1-5H3,(H,28,30)