(2E)-1-(3-bromanyl-4-fluoranyl-phenyl)-2-(2-methylsulfanyl-1H-pyrimidin-6-ylidene)ethanone

Systemtic Name: (2E)-1-(3-bromanyl-4-fluoranyl-phenyl)-2-(2-methylsulfanyl-1H-pyrimidin-6-ylidene)ethanone Openeye Name: (2E)-1-(3-bromo-4-fluoro-phenyl)-2-(2-methylsulfanyl-1H-pyrimidin-6-ylidene)ethanone CAS Name: (2E)-1-(3-bromo-4-fluorophenyl)-2-[2-(methylthio)-1H-pyrimidin-6-ylidene]ethanone IUPAC Name: (2E)-1-(3-bromo-4-fluorophenyl)-2-(2-methylsulfanyl-1H-pyrimidin-6-ylidene)ethanone Traditional Name: (2E)-1-(3-bromo-4-fluoro-phenyl)-2-[2-(methylthio)-1H-pyrimidin-6-ylidene]ethanone Formula: C13H10BrFN2OS MolecularWeight: 341.198703

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=CC(=O)C2=CC(=C(C=C2)F)Br)N1

Isomeric SMILES

CSC1=NC=C/C(=C\C(=O)C2=CC(=C(C=C2)F)Br)/N1

InChI

InChI=1S/C13H10BrFN2OS/c1-19-13-16-5-4-9(17-13)7-12(18)8-2-3-11(15)10(14)6-8/h2-7H,1H3,(H,16,17)/b9-7+