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

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[(4-methoxyphenyl)methylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(4-methoxyphenyl)methylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 6-methyl-2-(p-anisylthio)pyrimidin-4-olate Formula: C13H13N2O2S- MolecularWeight: 261.31952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)OC)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)OC)[O-]

InChI

InChI=1S/C13H14N2O2S/c1-9-7-12(16)15-13(14-9)18-8-10-3-5-11(17-2)6-4-10/h3-7H,8H2,1-2H3,(H,14,15,16)/p-1