1-[4-(4-bromophenyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(4-bromophenyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(4-bromophenyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-[4-(4-bromophenyl)phenyl]-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-[4-(4-bromophenyl)phenyl]-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-[4-(4-bromophenyl)phenyl]-2-(2-pyrimidylthio)ethanone Formula: C18H13BrN2OS MolecularWeight: 385.27762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H13BrN2OS/c19-16-8-6-14(7-9-16)13-2-4-15(5-3-13)17(22)12-23-18-20-10-1-11-21-18/h1-11H,12H2