2-(4-phenoxybutylsulfanyl)-1-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 2-(4-phenoxybutylsulfanyl)-1-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 2-(4-phenoxybutylsulfanyl)-1-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 2-(4-phenoxybutylthio)-1-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 2-(4-phenoxybutylsulfanyl)-1-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 2-(4-phenoxybutylthio)-1-(3,4,5-trimethoxyphenyl)ethanone Formula: C21H26O5S MolecularWeight: 390.49314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CSCCCCOC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CSCCCCOC2=CC=CC=C2

InChI

InChI=1S/C21H26O5S/c1-23-19-13-16(14-20(24-2)21(19)25-3)18(22)15-27-12-8-7-11-26-17-9-5-4-6-10-17/h4-6,9-10,13-14H,7-8,11-12,15H2,1-3H3