2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(2-chloro-6-fluoro-benzyl)thio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H16ClFN2OS2 MolecularWeight: 442.956643

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC3=C(C=CC=C3Cl)F)SC=C2C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC3=C(C=CC=C3Cl)F)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C22H16ClFN2OS2/c1-2-11-26-21(27)19-15(14-7-4-3-5-8-14)12-28-20(19)25-22(26)29-13-16-17(23)9-6-10-18(16)24/h2-10,12H,1,11,13H2