N-(1-cyanocyclohexyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]-N-methyl-acetamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)N(C)C3(CCCCC3)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)N(C)C3(CCCCC3)C#N)C

InChI

InChI=1S/C21H26N4OS/c1-16-7-8-18(17(2)13-16)25-12-11-23-20(25)27-14-19(26)24(3)21(15-22)9-5-4-6-10-21/h7-8,11-13H,4-6,9-10,14H2,1-3H3