N-(2-cyano-1-benzofuran-3-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]acetamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)NC3=C(OC4=CC=CC=C43)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)NC3=C(OC4=CC=CC=C43)C#N)C

InChI

InChI=1S/C22H18N4O2S/c1-14-7-8-17(15(2)11-14)26-10-9-24-22(26)29-13-20(27)25-21-16-5-3-4-6-18(16)28-19(21)12-23/h3-11H,13H2,1-2H3,(H,25,27)