4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-7-hydroxychromen-2-one Traditional Name: 4-[[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-7-hydroxy-coumarin Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=CC(=O)OC4=C3C=CC(=C4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)SCC3=CC(=O)OC4=C3C=CC(=C4)O)OC

InChI

InChI=1S/C20H16N2O6S/c1-25-15-6-3-11(7-17(15)26-2)19-21-22-20(28-19)29-10-12-8-18(24)27-16-9-13(23)4-5-14(12)16/h3-9,23H,10H2,1-2H3