tert-butyl 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C15H16N2O5S MolecularWeight: 336.36294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN=C(O1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN=C(O1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H16N2O5S/c1-15(2,3)22-12(18)7-23-14-17-16-13(21-14)9-4-5-10-11(6-9)20-8-19-10/h4-6H,7-8H2,1-3H3