3-[4-chloranyl-3-(1-oxidanylidenethiolan-2-yl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-[4-chloranyl-3-(1-oxidanylidenethiolan-2-yl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-[4-chloro-3-(1-oxothiolan-2-yl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-[4-chloro-3-(1-oxo-2-thiolanyl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-[4-chloro-3-(1-oxothiolan-2-yl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-[4-chloro-3-(1-ketothiolan-2-yl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C16H14ClF3N2O3S MolecularWeight: 406.80717

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=CC(=C(C=C2)Cl)C3CCCS3=O)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=CC(=C(C=C2)Cl)C3CCCS3=O)C(F)(F)F

InChI

InChI=1S/C16H14ClF3N2O3S/c1-21-13(16(18,19)20)8-14(23)22(15(21)24)9-4-5-11(17)10(7-9)12-3-2-6-26(12)25/h4-5,7-8,12H,2-3,6H2,1H3