N-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)quinoline-2-carboxamide

Systemtic Name: N-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)quinoline-2-carboxamide Openeye Name: N-(6-hydroxy-4-oxo-2-thioxo-1H-pyrimidin-5-yl)quinoline-2-carboxamide CAS Name: N-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-2-quinolinecarboxamide IUPAC Name: N-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)quinoline-2-carboxamide Traditional Name: N-(6-hydroxy-4-keto-2-thioxo-1H-pyrimidin-5-yl)quinaldamide Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3=C(NC(=S)NC3=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3=C(NC(=S)NC3=O)O

InChI

InChI=1S/C14H10N4O3S/c19-11(16-10-12(20)17-14(22)18-13(10)21)9-6-5-7-3-1-2-4-8(7)15-9/h1-6H,(H,16,19)(H3,17,18,20,21,22)