2-[2-(2-cyanophenoxy)ethylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(2-cyanophenoxy)ethylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-(2-cyanophenoxy)ethylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[2-(2-cyanophenoxy)ethylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-(2-cyanophenoxy)ethylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[2-(2-cyanophenoxy)ethylthio]-6-methyl-pyrimidin-4-olate Formula: C14H12N3O2S- MolecularWeight: 286.32898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCOC2=CC=CC=C2C#N)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCCOC2=CC=CC=C2C#N)[O-]

InChI

InChI=1S/C14H13N3O2S/c1-10-8-13(18)17-14(16-10)20-7-6-19-12-5-3-2-4-11(12)9-15/h2-5,8H,6-7H2,1H3,(H,16,17,18)/p-1