2-[(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-quinolin-4-yl-ethanamide

Systemtic Name: 2-[(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-quinolin-4-yl-ethanamide Openeye Name: 2-[(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-quinolyl)acetamide CAS Name: 2-[(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-(4-quinolinyl)acetamide IUPAC Name: 2-[(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-quinolin-4-ylacetamide Traditional Name: 2-[(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)thio]-N-(4-quinolyl)acetamide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC(=O)NC2=CC=NC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC(=O)NC2=CC=NC3=CC=CC=C32)C

InChI

InChI=1S/C17H16N4O2S/c1-10-11(2)19-17(21-16(10)23)24-9-15(22)20-14-7-8-18-13-6-4-3-5-12(13)14/h3-8H,9H2,1-2H3,(H,18,20,22)(H,19,21,23)