6-oxidanylidene-2-phenyl-5-(thiolan-1-ium-1-yl)-1H-pyrimidin-4-olate

Systemtic Name: 6-oxidanylidene-2-phenyl-5-(thiolan-1-ium-1-yl)-1H-pyrimidin-4-olate Openeye Name: 6-oxo-2-phenyl-5-tetrahydrothiophen-1-ium-1-yl-1H-pyrimidin-4-olate CAS Name: 6-oxo-2-phenyl-5-(1-thiolan-1-iumyl)-1H-pyrimidin-4-olate IUPAC Name: 6-oxo-2-phenyl-5-(thiolan-1-ium-1-yl)-1H-pyrimidin-4-olate Traditional Name: 6-keto-2-phenyl-5-tetrahydrothiophen-1-ium-1-yl-1H-pyrimidin-4-olate Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[S+](C1)C2=C(N=C(NC2=O)C3=CC=CC=C3)[O-]

Isomeric SMILES

C1CC[S+](C1)C2=C(N=C(NC2=O)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C14H14N2O2S/c17-13-11(19-8-4-5-9-19)14(18)16-12(15-13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H-,15,16,17,18)