2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]pyrimidine-4-carboxamide

Systemtic Name: 2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]pyrimidine-4-carboxamide Openeye Name: 2-(4,4-difluorobut-3-enylsulfanyl)pyrimidine-4-carboxamide CAS Name: 2-(4,4-difluorobut-3-enylthio)-4-pyrimidinecarboxamide IUPAC Name: 2-(4,4-difluorobut-3-enylsulfanyl)pyrimidine-4-carboxamide Traditional Name: 2-(4,4-difluorobut-3-enylthio)pyrimidine-4-carboxamide Formula: C9H9F2N3OS MolecularWeight: 245.249066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1C(=O)N)SCCC=C(F)F

Isomeric SMILES

C1=CN=C(N=C1C(=O)N)SCCC=C(F)F

InChI

InChI=1S/C9H9F2N3OS/c10-7(11)2-1-5-16-9-13-4-3-6(14-9)8(12)15/h2-4H,1,5H2,(H2,12,15)