N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(5-chloro-8-hydroxy-7-quinolyl)methyl]-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(5-chloro-8-hydroxy-7-quinolinyl)methyl]-2-[(1-methyl-5-phenyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[(5-chloro-8-hydroxy-7-quinolyl)methyl]-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetamide Formula: C22H19ClN4O2S MolecularWeight: 438.92986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)NCC2=CC(=C3C=CC=NC3=C2O)Cl)C4=CC=CC=C4

Isomeric SMILES

CN1C(=CN=C1SCC(=O)NCC2=CC(=C3C=CC=NC3=C2O)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H19ClN4O2S/c1-27-18(14-6-3-2-4-7-14)12-26-22(27)30-13-19(28)25-11-15-10-17(23)16-8-5-9-24-20(16)21(15)29/h2-10,12,29H,11,13H2,1H3,(H,25,28)