5,7-dimethyl-8-oxidanyl-N-[(4-oxidanylidene-1H-pyrimidin-6-yl)methyl]quinoline-2-carboxamide

Systemtic Name: 5,7-dimethyl-8-oxidanyl-N-[(4-oxidanylidene-1H-pyrimidin-6-yl)methyl]quinoline-2-carboxamide Openeye Name: 8-hydroxy-5,7-dimethyl-N-[(4-oxo-1H-pyrimidin-6-yl)methyl]quinoline-2-carboxamide CAS Name: 8-hydroxy-5,7-dimethyl-N-[(4-oxo-1H-pyrimidin-6-yl)methyl]-2-quinolinecarboxamide IUPAC Name: 8-hydroxy-5,7-dimethyl-N-[(4-oxo-1H-pyrimidin-6-yl)methyl]quinoline-2-carboxamide Traditional Name: 8-hydroxy-N-[(4-keto-1H-pyrimidin-6-yl)methyl]-5,7-dimethyl-quinaldamide Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C=CC(=N2)C(=O)NCC3=CC(=O)N=CN3)O)C

Isomeric SMILES

CC1=CC(=C(C2=C1C=CC(=N2)C(=O)NCC3=CC(=O)N=CN3)O)C

InChI

InChI=1S/C17H16N4O3/c1-9-5-10(2)16(23)15-12(9)3-4-13(21-15)17(24)18-7-11-6-14(22)20-8-19-11/h3-6,8,23H,7H2,1-2H3,(H,18,24)(H,19,20,22)