6-methyl-2-[[2,3,6-tris(chloranyl)phenyl]methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-[[2,3,6-tris(chloranyl)phenyl]methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-[(2,3,6-trichlorophenyl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[(2,3,6-trichlorophenyl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[(2,3,6-trichlorophenyl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-[(2,3,6-trichlorobenzyl)thio]-1H-pyrimidin-4-one Formula: C12H9Cl3N2OS MolecularWeight: 335.63666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2Cl)Cl)Cl

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2Cl)Cl)Cl

InChI

InChI=1S/C12H9Cl3N2OS/c1-6-4-10(18)17-12(16-6)19-5-7-8(13)2-3-9(14)11(7)15/h2-4H,5H2,1H3,(H,16,17,18)