2-[2-(4-chloranylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(4-chloranylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-(4-chlorophenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-(4-chlorophenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H13ClN2O2S/c1-9-8-12(17)16-13(15-9)19-7-6-18-11-4-2-10(14)3-5-11/h2-5,8H,6-7H2,1H3,(H,15,16,17)