3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-methyl-2-[[4-(trifluoromethyl)benzyl]thio]thieno[2,3-d]pyrimidin-4-one Formula: C15H11F3N2OS2 MolecularWeight: 356.38585

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)C(F)(F)F)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)C(F)(F)F)SC=C2

InChI

InChI=1S/C15H11F3N2OS2/c1-20-13(21)11-6-7-22-12(11)19-14(20)23-8-9-2-4-10(5-3-9)15(16,17)18/h2-7H,8H2,1H3