2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-6-ethanoyl-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-6-ethanoyl-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-acetyl-2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-acetyl-2-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-acetyl-2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-acetyl-2-[[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H11ClF3N3O2S2 MolecularWeight: 433.85565

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=C(C=C(C=N3)C(F)(F)F)Cl)C(=O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=C(C=C(C=N3)C(F)(F)F)Cl)C(=O)C

InChI

InChI=1S/C16H11ClF3N3O2S2/c1-6-11-13(25)22-10(23-15(11)27-12(6)7(2)24)5-26-14-9(17)3-8(4-21-14)16(18,19)20/h3-4H,5H2,1-2H3,(H,22,23,25)