2-[(4-chlorophenyl)methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4-olate CAS Name: 2-[(4-chlorophenyl)methylthio]-5-(2-hydroxyethyl)-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4-olate Traditional Name: 2-[(4-chlorobenzyl)thio]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4-olate Formula: C14H14ClN2O2S- MolecularWeight: 309.79116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN2O2S/c1-9-12(6-7-18)13(19)17-14(16-9)20-8-10-2-4-11(15)5-3-10/h2-5,18H,6-8H2,1H3,(H,16,17,19)/p-1