2-[3,4-bis(phenylmethoxy)phenyl]-5,8-bis(phenylmethoxy)thiochromen-4-one

Systemtic Name: 2-[3,4-bis(phenylmethoxy)phenyl]-5,8-bis(phenylmethoxy)thiochromen-4-one Openeye Name: 5,8-dibenzyloxy-2-(3,4-dibenzyloxyphenyl)thiochromen-4-one CAS Name: 2-[3,4-bis(phenylmethoxy)phenyl]-5,8-bis(phenylmethoxy)-1-benzothiopyran-4-one IUPAC Name: 2-[3,4-bis(phenylmethoxy)phenyl]-5,8-bis(phenylmethoxy)thiochromen-4-one Traditional Name: 5,8-dibenzoxy-2-(3,4-dibenzoxyphenyl)thiochromen-4-one Formula: C43H34O5S MolecularWeight: 662.79206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=CC(=O)C4=C(C=CC(=C4S3)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=CC(=O)C4=C(C=CC(=C4S3)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7

InChI

InChI=1S/C43H34O5S/c44-36-26-41(35-21-22-37(45-27-31-13-5-1-6-14-31)40(25-35)48-30-34-19-11-4-12-20-34)49-43-39(47-29-33-17-9-3-10-18-33)24-23-38(42(36)43)46-28-32-15-7-2-8-16-32/h1-26H,27-30H2