2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanyl-1H-pyrimidin-6-one bromide

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanyl-1H-pyrimidin-6-one bromide Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-4-hydroxy-1H-pyrimidin-6-one bromide CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4-hydroxy-1H-pyrimidin-6-one bromide IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4-hydroxy-1H-pyrimidin-6-one bromide Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4-hydroxy-1H-pyrimidin-6-one bromide Formula: C12H9Br2N2O3S- MolecularWeight: 421.08446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=NC(=CC(=O)N2)O)Br.[Br-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=NC(=CC(=O)N2)O)Br.[Br-]

InChI

InChI=1S/C12H9BrN2O3S.BrH/c13-8-3-1-7(2-4-8)9(16)6-19-12-14-10(17)5-11(18)15-12;/h1-5H,6H2,(H2,14,15,17,18);1H/p-1