4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl ethanoate

Systemtic Name: 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl ethanoate Openeye Name: 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl acetate CAS Name: acetic acid 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester IUPAC Name: 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl acetate Traditional Name: acetic acid 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester Formula: C14H11BrN2O3S MolecularWeight: 367.21774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC#CCSC1=NN=C(O1)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)OCC#CCSC1=NN=C(O1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H11BrN2O3S/c1-10(18)19-8-2-3-9-21-14-17-16-13(20-14)11-4-6-12(15)7-5-11/h4-7H,8-9H2,1H3