1-(azocan-1-yl)-2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(azocan-1-yl)-2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(azocan-1-yl)-2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(1-azocanyl)-2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(azocan-1-yl)-2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(azocan-1-yl)-2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3Br

Isomeric SMILES

C1CCCN(CCC1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3Br

InChI

InChI=1S/C17H20BrN3O2S/c18-14-9-5-4-8-13(14)16-19-20-17(23-16)24-12-15(22)21-10-6-2-1-3-7-11-21/h4-5,8-9H,1-3,6-7,10-12H2