5-dimethylsulfonio-3-naphthalen-1-yl-2,6-bis(oxidanylidene)pyrimidin-4-olate

Systemtic Name: 5-dimethylsulfonio-3-naphthalen-1-yl-2,6-bis(oxidanylidene)pyrimidin-4-olate Openeye Name: 5-dimethylsulfonio-3-(1-naphthyl)-2,6-dioxo-pyrimidin-4-olate CAS Name: 5-dimethylsulfonio-3-(1-naphthalenyl)-2,6-dioxo-4-pyrimidinolate IUPAC Name: 5-dimethylsulfonio-3-naphthalen-1-yl-2,6-dioxopyrimidin-4-olate Traditional Name: 5-dimethylsulfonio-2,6-diketo-3-(1-naphthyl)pyrimidin-4-olate Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](C)C1=C(N(C(=O)NC1=O)C2=CC=CC3=CC=CC=C32)[O-]

Isomeric SMILES

C[S+](C)C1=C(N(C(=O)NC1=O)C2=CC=CC3=CC=CC=C32)[O-]

InChI

InChI=1S/C16H14N2O3S/c1-22(2)13-14(19)17-16(21)18(15(13)20)12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3,(H-,17,19,20,21)