(5E)-4,6-bis(oxidanylidene)-5-[(6-thiomorpholin-4-ylpyridin-3-yl)methylidene]-1H-pyrimidin-2-olate

Systemtic Name: (5E)-4,6-bis(oxidanylidene)-5-[(6-thiomorpholin-4-ylpyridin-3-yl)methylidene]-1H-pyrimidin-2-olate Openeye Name: (5E)-4,6-dioxo-5-[(6-thiomorpholino-3-pyridyl)methylene]-1H-pyrimidin-2-olate CAS Name: (5E)-4,6-dioxo-5-[(6-thiomorpholin-4-yl-3-pyridinyl)methylidene]-1H-pyrimidin-2-olate IUPAC Name: (5E)-4,6-dioxo-5-[(6-thiomorpholin-4-ylpyridin-3-yl)methylidene]-1H-pyrimidin-2-olate Traditional Name: (5E)-4,6-diketo-5-[(6-thiomorpholino-3-pyridyl)methylene]-1H-pyrimidin-2-olate Formula: C14H13N4O3S- MolecularWeight: 317.34302

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=NC=C(C=C2)C=C3C(=O)NC(=NC3=O)[O-]

Isomeric SMILES

C1CSCCN1C2=NC=C(C=C2)/C=C/3\C(=O)NC(=NC3=O)[O-]

InChI

InChI=1S/C14H14N4O3S/c19-12-10(13(20)17-14(21)16-12)7-9-1-2-11(15-8-9)18-3-5-22-6-4-18/h1-2,7-8H,3-6H2,(H2,16,17,19,20,21)/p-1