2-(3-bromophenyl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(3-bromophenyl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(3-bromophenyl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-(3-bromophenyl)-5-[2-(3-nitrophenoxy)ethylthio]-1,3,4-oxadiazole IUPAC Name: 2-(3-bromophenyl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(3-bromophenyl)-5-[2-(3-nitrophenoxy)ethylthio]-1,3,4-oxadiazole Formula: C16H12BrN3O4S MolecularWeight: 422.25318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NN=C(O2)SCCOC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NN=C(O2)SCCOC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN3O4S/c17-12-4-1-3-11(9-12)15-18-19-16(24-15)25-8-7-23-14-6-2-5-13(10-14)20(21)22/h1-6,9-10H,7-8H2