2-[3,4-dimethoxy-2-(4-methylsulfanylphenyl)phenyl]-2-oxidanyl-1,2-diphenyl-ethanone

Systemtic Name: 2-[3,4-dimethoxy-2-(4-methylsulfanylphenyl)phenyl]-2-oxidanyl-1,2-diphenyl-ethanone Openeye Name: 2-[3,4-dimethoxy-2-(4-methylsulfanylphenyl)phenyl]-2-hydroxy-1,2-diphenyl-ethanone CAS Name: 2-[3,4-dimethoxy-2-[4-(methylthio)phenyl]phenyl]-2-hydroxy-1,2-diphenylethanone IUPAC Name: 2-[3,4-dimethoxy-2-(4-methylsulfanylphenyl)phenyl]-2-hydroxy-1,2-diphenylethanone Traditional Name: 2-[3,4-dimethoxy-2-[4-(methylthio)phenyl]phenyl]-2-hydroxy-1,2-diphenyl-ethanone Formula: C29H26O4S MolecularWeight: 470.57934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(C2=CC=CC=C2)(C(=O)C3=CC=CC=C3)O)C4=CC=C(C=C4)SC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(C2=CC=CC=C2)(C(=O)C3=CC=CC=C3)O)C4=CC=C(C=C4)SC)OC

InChI

InChI=1S/C29H26O4S/c1-32-25-19-18-24(26(27(25)33-2)20-14-16-23(34-3)17-15-20)29(31,22-12-8-5-9-13-22)28(30)21-10-6-4-7-11-21/h4-19,31H,1-3H3