4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one

Systemtic Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one Openeye Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one CAS Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]-2-butanone IUPAC Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-2-one Traditional Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]butan-2-one Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC1=NN=C(O1)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)CCSC1=NN=C(O1)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C14H16N2O4S/c1-9(17)6-7-21-14-16-15-13(20-14)10-4-5-11(18-2)12(8-10)19-3/h4-5,8H,6-7H2,1-3H3