(5S)-6-oxidanylidene-1-phenyl-5-(pyridin-2-ylmethyliminomethyl)-2-sulfanylidene-5H-pyrimidin-4-olate

Systemtic Name: (5S)-6-oxidanylidene-1-phenyl-5-(pyridin-2-ylmethyliminomethyl)-2-sulfanylidene-5H-pyrimidin-4-olate Openeye Name: (5S)-6-oxo-1-phenyl-5-(2-pyridylmethyliminomethyl)-2-thioxo-5H-pyrimidin-4-olate CAS Name: (5S)-6-oxo-1-phenyl-5-(2-pyridinylmethyliminomethyl)-2-sulfanylidene-5H-pyrimidin-4-olate IUPAC Name: (5S)-6-oxo-1-phenyl-5-(pyridin-2-ylmethyliminomethyl)-2-sulfanylidene-5H-pyrimidin-4-olate Traditional Name: (5S)-6-keto-1-phenyl-5-(2-pyridylmethyliminomethyl)-2-thioxo-5H-pyrimidin-4-olate Formula: C17H13N4O2S- MolecularWeight: 337.37572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(C(=NC2=S)[O-])C=NCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)[C@H](C(=NC2=S)[O-])C=NCC3=CC=CC=N3

InChI

InChI=1S/C17H14N4O2S/c22-15-14(11-18-10-12-6-4-5-9-19-12)16(23)21(17(24)20-15)13-7-2-1-3-8-13/h1-9,11,14H,10H2,(H,20,22,24)/p-1/t14-/m0/s1