1-(3-bromanyl-4-methoxy-phenyl)-2-tert-butylsulfanyl-ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-tert-butylsulfanyl-ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-tert-butylsulfanyl-ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-(tert-butylthio)ethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-tert-butylsulfanylethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-(tert-butylthio)ethanone Formula: C13H17BrO2S MolecularWeight: 317.24188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CC(C)(C)SCC(=O)C1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C13H17BrO2S/c1-13(2,3)17-8-11(15)9-5-6-12(16-4)10(14)7-9/h5-7H,8H2,1-4H3