7-deuterio-2-[2-(1,3-dithian-2-yl)-1-phenyl-ethyl]-4,6-dimethoxy-2-(4-methoxyphenyl)-1-benzofuran-3-one

Systemtic Name: 7-deuterio-2-[2-(1,3-dithian-2-yl)-1-phenyl-ethyl]-4,6-dimethoxy-2-(4-methoxyphenyl)-1-benzofuran-3-one Openeye Name: 7-deuterio-2-[2-(1,3-dithian-2-yl)-1-phenyl-ethyl]-4,6-dimethoxy-2-(4-methoxyphenyl)benzofuran-3-one CAS Name: 7-deuterio-2-[2-(1,3-dithian-2-yl)-1-phenylethyl]-4,6-dimethoxy-2-(4-methoxyphenyl)-3-benzofuranone IUPAC Name: 7-deuterio-2-[2-(1,3-dithian-2-yl)-1-phenylethyl]-4,6-dimethoxy-2-(4-methoxyphenyl)-1-benzofuran-3-one Traditional Name: 7-deuterio-2-[2-(1,3-dithian-2-yl)-1-phenyl-ethyl]-4,6-dimethoxy-2-(4-methoxyphenyl)coumaran-3-one Formula: C29H30O5S2 MolecularWeight: 523.681662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C(=O)C3=C(C=C(C=C3O2)OC)OC)C(CC4SCCCS4)C5=CC=CC=C5

Isomeric SMILES

[2H]C1=C2C(=C(C=C1OC)OC)C(=O)C(O2)(C3=CC=C(C=C3)OC)C(CC4SCCCS4)C5=CC=CC=C5

InChI

InChI=1S/C29H30O5S2/c1-31-21-12-10-20(11-13-21)29(28(30)27-24(33-3)16-22(32-2)17-25(27)34-29)23(19-8-5-4-6-9-19)18-26-35-14-7-15-36-26/h4-6,8-13,16-17,23,26H,7,14-15,18H2,1-3H3/i17D