1-(3-methylsulfanyl-4-oxidanyl-phenyl)-2-[2-(3,4,5-trimethoxyphenyl)ethylamino]ethanone

Systemtic Name: 1-(3-methylsulfanyl-4-oxidanyl-phenyl)-2-[2-(3,4,5-trimethoxyphenyl)ethylamino]ethanone Openeye Name: 1-(4-hydroxy-3-methylsulfanyl-phenyl)-2-[2-(3,4,5-trimethoxyphenyl)ethylamino]ethanone CAS Name: 1-[4-hydroxy-3-(methylthio)phenyl]-2-[2-(3,4,5-trimethoxyphenyl)ethylamino]ethanone IUPAC Name: 1-(4-hydroxy-3-methylsulfanylphenyl)-2-[2-(3,4,5-trimethoxyphenyl)ethylamino]ethanone Traditional Name: 1-[4-hydroxy-3-(methylthio)phenyl]-2-[2-(3,4,5-trimethoxyphenyl)ethylamino]ethanone Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCNCC(=O)C2=CC(=C(C=C2)O)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCNCC(=O)C2=CC(=C(C=C2)O)SC

InChI

InChI=1S/C20H25NO5S/c1-24-17-9-13(10-18(25-2)20(17)26-3)7-8-21-12-16(23)14-5-6-15(22)19(11-14)27-4/h5-6,9-11,21-22H,7-8,12H2,1-4H3