N-cyclooctyl-2-[4-(1-methylimidazol-2-yl)carbonylquinolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclooctyl-2-[4-(1-methylimidazol-2-yl)carbonylquinolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclooctyl-2-[[4-(1-methylimidazole-2-carbonyl)-2-quinolyl]sulfanyl]acetamide CAS Name: N-cyclooctyl-2-[[4-[(1-methyl-2-imidazolyl)-oxomethyl]-2-quinolinyl]thio]acetamide IUPAC Name: N-cyclooctyl-2-[4-(1-methylimidazole-2-carbonyl)quinolin-2-yl]sulfanylacetamide Traditional Name: N-cyclooctyl-2-[[4-(1-methylimidazole-2-carbonyl)-2-quinolyl]thio]acetamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4CCCCCCC4

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4CCCCCCC4

InChI

InChI=1S/C24H28N4O2S/c1-28-14-13-25-24(28)23(30)19-15-22(27-20-12-8-7-11-18(19)20)31-16-21(29)26-17-9-5-3-2-4-6-10-17/h7-8,11-15,17H,2-6,9-10,16H2,1H3,(H,26,29)