1-(2-bromophenyl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(2-bromophenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(2-bromophenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(2-bromophenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(2-bromophenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(2-bromophenyl)-2-(2-pyrimidylthio)ethanone Formula: C12H9BrN2OS MolecularWeight: 309.18166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)CSC2=NC=CC=N2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)CSC2=NC=CC=N2)Br

InChI

InChI=1S/C12H9BrN2OS/c13-10-5-2-1-4-9(10)11(16)8-17-12-14-6-3-7-15-12/h1-7H,8H2