1-phenyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one

Systemtic Name: 1-phenyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 1-phenyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-phenyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-phenyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 1-phenyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]propan-1-one Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NN=C(O2)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NN=C(O2)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C20H20N2O5S/c1-12(17(23)13-8-6-5-7-9-13)28-20-22-21-19(27-20)14-10-15(24-2)18(26-4)16(11-14)25-3/h5-12H,1-4H3