1-[2,4-bis(fluoranyl)phenyl]-2-(4-naphthalen-2-ylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-2-(4-naphthalen-2-ylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2,4-difluorophenyl)-2-[4-(2-naphthyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(2,4-difluorophenyl)-2-[[4-(2-naphthalenyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(2,4-difluorophenyl)-2-(4-naphthalen-2-ylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(2,4-difluorophenyl)-2-[[4-(2-naphthyl)pyrimidin-2-yl]thio]ethanone Formula: C22H14F2N2OS MolecularWeight: 392.421166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NC(=NC=C3)SCC(=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NC(=NC=C3)SCC(=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C22H14F2N2OS/c23-17-7-8-18(19(24)12-17)21(27)13-28-22-25-10-9-20(26-22)16-6-5-14-3-1-2-4-15(14)11-16/h1-12H,13H2