2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(6-chloro-3-pyridyl)methylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[(6-chloro-3-pyridinyl)methylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(6-chloropyridin-3-yl)methylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[(6-chloro-3-pyridyl)methylthio]-6-methyl-pyrimidin-4-olate Formula: C11H9ClN3OS- MolecularWeight: 266.72666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClN3OS/c1-7-4-10(16)15-11(14-7)17-6-8-2-3-9(12)13-5-8/h2-5H,6H2,1H3,(H,14,15,16)/p-1