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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCCSC2=NC(=CC(=N2)[O-])C)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OCCSC2=NC(=CC(=N2)[O-])C)Cl

InChI

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