5-thiophen-2-yl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-thiophen-2-yl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(2-thienyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-thiophen-2-yl-2-[[3-(trifluoromethyl)phenyl]methylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-thiophen-2-yl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(2-thienyl)-2-[[3-(trifluoromethyl)benzyl]thio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H11F3N2OS3 MolecularWeight: 424.48295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

InChI

InChI=1S/C18H11F3N2OS3/c19-18(20,21)11-4-1-3-10(7-11)8-27-17-22-15(24)14-12(9-26-16(14)23-17)13-5-2-6-25-13/h1-7,9H,8H2,(H,22,23,24)