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

Systemtic Name: 2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 2-(4,4-difluorobut-3-enylsulfanyl)pyrimidine-4-carbonitrile CAS Name: 2-(4,4-difluorobut-3-enylthio)-4-pyrimidinecarbonitrile IUPAC Name: 2-(4,4-difluorobut-3-enylsulfanyl)pyrimidine-4-carbonitrile Traditional Name: 2-(4,4-difluorobut-3-enylthio)pyrimidine-4-carbonitrile Formula: C9H7F2N3S MolecularWeight: 227.233786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7F2N3S/c10-8(11)2-1-5-15-9-13-4-3-7(6-12)14-9/h2-4H,1,5H2