2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-6-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-6-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C12H7Cl2F3N2OS MolecularWeight: 355.16299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CSC2=NC(=O)C=C(N2)C(F)(F)F)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CSC2=NC(=O)C=C(N2)C(F)(F)F)Cl)Cl

InChI

InChI=1S/C12H7Cl2F3N2OS/c13-7-2-1-6(3-8(7)14)5-21-11-18-9(12(15,16)17)4-10(20)19-11/h1-4H,5H2,(H,18,19,20)