3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-[(4-methoxyphenyl)methyl]-2-(methylthio)-6-oxo-4-pyrimidinolate IUPAC Name: 3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-6-oxopyrimidin-4-olate Traditional Name: 6-keto-2-(methylthio)-3-p-anisyl-pyrimidin-4-olate Formula: C13H13N2O3S- MolecularWeight: 277.31892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=CC(=O)N=C2SC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=CC(=O)N=C2SC)[O-]

InChI

InChI=1S/C13H14N2O3S/c1-18-10-5-3-9(4-6-10)8-15-12(17)7-11(16)14-13(15)19-2/h3-7,17H,8H2,1-2H3/p-1