[2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-4-methyl-pyrimidin-5-yl]-phenyl-methanone

Systemtic Name: [2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-4-methyl-pyrimidin-5-yl]-phenyl-methanone Openeye Name: [2-(4,4-difluorobut-3-enylsulfanyl)-4-methyl-pyrimidin-5-yl]-phenyl-methanone CAS Name: [2-(4,4-difluorobut-3-enylthio)-4-methyl-5-pyrimidinyl]-phenylmethanone IUPAC Name: [2-(4,4-difluorobut-3-enylsulfanyl)-4-methylpyrimidin-5-yl]-phenylmethanone Traditional Name: [2-(4,4-difluorobut-3-enylthio)-4-methyl-pyrimidin-5-yl]-phenyl-methanone Formula: C16H14F2N2OS MolecularWeight: 320.356966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)C2=CC=CC=C2)SCCC=C(F)F

Isomeric SMILES

CC1=NC(=NC=C1C(=O)C2=CC=CC=C2)SCCC=C(F)F

InChI

InChI=1S/C16H14F2N2OS/c1-11-13(15(21)12-6-3-2-4-7-12)10-19-16(20-11)22-9-5-8-14(17)18/h2-4,6-8,10H,5,9H2,1H3