2-butylsulfanyl-3-[3-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-3-[3-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Openeye Name: 2-butylsulfanyl-3-[3-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one CAS Name: 2-(butylthio)-3-[3-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-3-[3-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Traditional Name: 2-(butylthio)-3-[3-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Formula: C17H17F3N2OS2 MolecularWeight: 386.45489

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=O)N1C3=CC=CC(=C3)C(F)(F)F)SCC2

Isomeric SMILES

CCCCSC1=NC2=C(C(=O)N1C3=CC=CC(=C3)C(F)(F)F)SCC2

InChI

InChI=1S/C17H17F3N2OS2/c1-2-3-8-25-16-21-13-7-9-24-14(13)15(23)22(16)12-6-4-5-11(10-12)17(18,19)20/h4-6,10H,2-3,7-9H2,1H3