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

Systemtic Name: 2-[4-(1-methylimidazol-2-yl)carbonylquinolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[[4-(1-methylimidazole-2-carbonyl)-2-quinolyl]sulfanyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[4-[(1-methyl-2-imidazolyl)-oxomethyl]-2-quinolinyl]thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-(1-methylimidazole-2-carbonyl)quinolin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[4-(1-methylimidazole-2-carbonyl)-2-quinolyl]thio]-N-(2-thenyl)acetamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CS4

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H18N4O2S2/c1-25-9-8-22-21(25)20(27)16-11-19(24-17-7-3-2-6-15(16)17)29-13-18(26)23-12-14-5-4-10-28-14/h2-11H,12-13H2,1H3,(H,23,26)