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

Systemtic Name: 7-bromanyl-4-[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]coumarin Formula: C20H15BrN2O5S MolecularWeight: 475.3125

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15BrN2O5S/c1-25-14-5-11(6-15(9-14)26-2)19-22-23-20(28-19)29-10-12-7-18(24)27-17-8-13(21)3-4-16(12)17/h3-9H,10H2,1-2H3