3-ethyl-6-oxidanylidene-2-prop-2-enylsulfanyl-pyrimidin-4-olate

Systemtic Name: 3-ethyl-6-oxidanylidene-2-prop-2-enylsulfanyl-pyrimidin-4-olate Openeye Name: 2-allylsulfanyl-3-ethyl-6-oxo-pyrimidin-4-olate CAS Name: 3-ethyl-6-oxo-2-(prop-2-enylthio)-4-pyrimidinolate IUPAC Name: 3-ethyl-6-oxo-2-prop-2-enylsulfanylpyrimidin-4-olate Traditional Name: 2-(allylthio)-3-ethyl-6-keto-pyrimidin-4-olate Formula: C9H11N2O2S- MolecularWeight: 211.26084

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=O)N=C1SCC=C)[O-]

Isomeric SMILES

CCN1C(=CC(=O)N=C1SCC=C)[O-]

InChI

InChI=1S/C9H12N2O2S/c1-3-5-14-9-10-7(12)6-8(13)11(9)4-2/h3,6,13H,1,4-5H2,2H3/p-1