2-[2-(3-bromanylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(3-bromanylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(3-bromophenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-(3-bromophenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(3-bromophenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-(3-bromophenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one Formula: C13H13BrN2O2S MolecularWeight: 341.22352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN2O2S/c1-9-7-12(17)16-13(15-9)19-6-5-18-11-4-2-3-10(14)8-11/h2-4,7-8H,5-6H2,1H3,(H,15,16,17)