1-(4-bromophenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanol

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanol Openeye Name: 1-(4-bromophenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanol CAS Name: 1-(4-bromophenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]ethanol IUPAC Name: 1-(4-bromophenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanol Traditional Name: 1-(4-bromophenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]ethanol Formula: C16H12BrN3O4S MolecularWeight: 422.25318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(O2)SCC(C3=CC=C(C=C3)Br)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(O2)SCC(C3=CC=C(C=C3)Br)O)[N+](=O)[O-]

InChI

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