2-[3-(4-methoxyphenyl)propylamino]-1-(3-methylsulfanyl-4-oxidanyl-phenyl)ethanone hydrobromide

Systemtic Name: 2-[3-(4-methoxyphenyl)propylamino]-1-(3-methylsulfanyl-4-oxidanyl-phenyl)ethanone hydrobromide Openeye Name: 1-(4-hydroxy-3-methylsulfanyl-phenyl)-2-[3-(4-methoxyphenyl)propylamino]ethanone hydrobromide CAS Name: 1-[4-hydroxy-3-(methylthio)phenyl]-2-[3-(4-methoxyphenyl)propylamino]ethanone hydrobromide IUPAC Name: 1-(4-hydroxy-3-methylsulfanylphenyl)-2-[3-(4-methoxyphenyl)propylamino]ethanone hydrobromide Traditional Name: 1-[4-hydroxy-3-(methylthio)phenyl]-2-[3-(4-methoxyphenyl)propylamino]ethanone hydrobromide Formula: C19H24BrNO3S MolecularWeight: 426.36776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCNCC(=O)C2=CC(=C(C=C2)O)SC.Br

Isomeric SMILES

COC1=CC=C(C=C1)CCCNCC(=O)C2=CC(=C(C=C2)O)SC.Br

InChI

InChI=1S/C19H23NO3S.BrH/c1-23-16-8-5-14(6-9-16)4-3-11-20-13-18(22)15-7-10-17(21)19(12-15)24-2;/h5-10,12,20-21H,3-4,11,13H2,1-2H3;1H