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

Systemtic Name: 6-methyl-2-[2-(2-methylphenoxy)ethylsulfanyl]pyrimidin-4-olate Openeye Name: 6-methyl-2-[2-(2-methylphenoxy)ethylsulfanyl]pyrimidin-4-olate CAS Name: 6-methyl-2-[2-(2-methylphenoxy)ethylthio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[2-(2-methylphenoxy)ethylsulfanyl]pyrimidin-4-olate Traditional Name: 6-methyl-2-[2-(2-methylphenoxy)ethylthio]pyrimidin-4-olate Formula: C14H15N2O2S- MolecularWeight: 275.3461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCSC2=NC(=CC(=N2)[O-])C

Isomeric SMILES

CC1=CC=CC=C1OCCSC2=NC(=CC(=N2)[O-])C

InChI

InChI=1S/C14H16N2O2S/c1-10-5-3-4-6-12(10)18-7-8-19-14-15-11(2)9-13(17)16-14/h3-6,9H,7-8H2,1-2H3,(H,15,16,17)/p-1