2-(4-bromophenyl)-5-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-bromophenyl)-5-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(4-bromophenyl)-5-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3,4-oxadiazole CAS Name: 2-(4-bromophenyl)-5-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)thio]-1,3,4-oxadiazole IUPAC Name: 2-(4-bromophenyl)-5-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(4-bromophenyl)-5-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)thio]-1,3,4-oxadiazole Formula: C11H7BrN6O3S MolecularWeight: 383.18068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])SC2=NN=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])SC2=NN=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C11H7BrN6O3S/c1-17-10(13-9(16-17)18(19)20)22-11-15-14-8(21-11)6-2-4-7(12)5-3-6/h2-5H,1H3