2-[2-(2-chloranyl-3,6-dimethyl-phenoxy)ethylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(2-chloranyl-3,6-dimethyl-phenoxy)ethylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-(2-chloro-3,6-dimethyl-phenoxy)ethylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[2-(2-chloro-3,6-dimethylphenoxy)ethylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-(2-chloro-3,6-dimethylphenoxy)ethylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[2-(2-chloro-3,6-dimethyl-phenoxy)ethylthio]-6-methyl-pyrimidin-4-olate Formula: C15H16ClN2O2S- MolecularWeight: 323.81774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)Cl)OCCSC2=NC(=CC(=N2)[O-])C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)Cl)OCCSC2=NC(=CC(=N2)[O-])C

InChI

InChI=1S/C15H17ClN2O2S/c1-9-4-5-10(2)14(13(9)16)20-6-7-21-15-17-11(3)8-12(19)18-15/h4-5,8H,6-7H2,1-3H3,(H,17,18,19)/p-1