N-[4-(cyanomethyl)phenyl]-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-[(1-o-cumenylimidazol-2-yl)thio]acetamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C22H22N4OS/c1-16(2)19-5-3-4-6-20(19)26-14-13-24-22(26)28-15-21(27)25-18-9-7-17(8-10-18)11-12-23/h3-10,13-14,16H,11,15H2,1-2H3,(H,25,27)