2-(3,4-dimethoxyphenyl)-5,8-bis(phenylmethoxy)-2,3-dihydrothiochromen-4-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5,8-bis(phenylmethoxy)-2,3-dihydrothiochromen-4-one Openeye Name: 5,8-dibenzyloxy-2-(3,4-dimethoxyphenyl)thiochroman-4-one CAS Name: 2-(3,4-dimethoxyphenyl)-5,8-bis(phenylmethoxy)-2,3-dihydro-1-benzothiopyran-4-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-5,8-bis(phenylmethoxy)-2,3-dihydrothiochromen-4-one Traditional Name: 5,8-dibenzoxy-2-(3,4-dimethoxyphenyl)thiochroman-4-one Formula: C31H28O5S MolecularWeight: 512.61602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=CC(=C3S2)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=CC(=C3S2)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC

InChI

InChI=1S/C31H28O5S/c1-33-25-14-13-23(17-28(25)34-2)29-18-24(32)30-26(35-19-21-9-5-3-6-10-21)15-16-27(31(30)37-29)36-20-22-11-7-4-8-12-22/h3-17,29H,18-20H2,1-2H3