2-[4-[(4-chlorophenyl)methylidene]-1-methyl-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-octyl-ethanamide

Systemtic Name: 2-[4-[(4-chlorophenyl)methylidene]-1-methyl-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-octyl-ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)methylene]-1-methyl-5-oxo-imidazol-2-yl]sulfanyl-N-octyl-acetamide CAS Name: 2-[[4-[(4-chlorophenyl)methylidene]-1-methyl-5-oxo-2-imidazolyl]thio]-N-octylacetamide IUPAC Name: 2-[4-[(4-chlorophenyl)methylidene]-1-methyl-5-oxoimidazol-2-yl]sulfanyl-N-octylacetamide Traditional Name: 2-[[4-(4-chlorobenzylidene)-5-keto-1-methyl-2-imidazolin-2-yl]thio]-N-octyl-acetamide Formula: C21H28ClN3O2S MolecularWeight: 421.98392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)CSC1=NC(=CC2=CC=C(C=C2)Cl)C(=O)N1C

Isomeric SMILES

CCCCCCCCNC(=O)CSC1=NC(=CC2=CC=C(C=C2)Cl)C(=O)N1C

InChI

InChI=1S/C21H28ClN3O2S/c1-3-4-5-6-7-8-13-23-19(26)15-28-21-24-18(20(27)25(21)2)14-16-9-11-17(22)12-10-16/h9-12,14H,3-8,13,15H2,1-2H3,(H,23,26)