azanium 2-ethylsulfanyl-6-oxidanylidene-3-phenyl-pyrimidin-4-olate

Systemtic Name: azanium 2-ethylsulfanyl-6-oxidanylidene-3-phenyl-pyrimidin-4-olate Openeye Name: ammonium 2-ethylsulfanyl-6-oxo-3-phenyl-pyrimidin-4-olate CAS Name: ammonium 2-(ethylthio)-6-oxo-3-phenyl-4-pyrimidinolate IUPAC Name: azanium 2-ethylsulfanyl-6-oxo-3-phenylpyrimidin-4-olate Traditional Name: ammonium 2-(ethylthio)-6-keto-3-phenyl-pyrimidin-4-olate Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C=C(N1C2=CC=CC=C2)[O-].[NH4+]

Isomeric SMILES

CCSC1=NC(=O)C=C(N1C2=CC=CC=C2)[O-].[NH4+]

InChI

InChI=1S/C12H12N2O2S.H3N/c1-2-17-12-13-10(15)8-11(16)14(12)9-6-4-3-5-7-9;/h3-8,16H,2H2,1H3;1H3