4-[2-[4-[methyl(phenyl)amino]butylamino]-1-oxidanyl-ethyl]-2-methylsulfanyl-phenol

Systemtic Name: 4-[2-[4-[methyl(phenyl)amino]butylamino]-1-oxidanyl-ethyl]-2-methylsulfanyl-phenol Openeye Name: 4-[1-hydroxy-2-[4-(N-methylanilino)butylamino]ethyl]-2-methylsulfanyl-phenol CAS Name: 4-[1-hydroxy-2-[4-(N-methylanilino)butylamino]ethyl]-2-(methylthio)phenol IUPAC Name: 4-[1-hydroxy-2-[4-(N-methylanilino)butylamino]ethyl]-2-methylsulfanylphenol Traditional Name: 4-[1-hydroxy-2-[4-(N-methylanilino)butylamino]ethyl]-2-(methylthio)phenol Formula: C20H28N2O2S MolecularWeight: 360.51352

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCNCC(C1=CC(=C(C=C1)O)SC)O)C2=CC=CC=C2

Isomeric SMILES

CN(CCCCNCC(C1=CC(=C(C=C1)O)SC)O)C2=CC=CC=C2

InChI

InChI=1S/C20H28N2O2S/c1-22(17-8-4-3-5-9-17)13-7-6-12-21-15-19(24)16-10-11-18(23)20(14-16)25-2/h3-5,8-11,14,19,21,23-24H,6-7,12-13,15H2,1-2H3