2-(2-bromophenyl)-5-[2-(4-methylphenyl)sulfanyl-5-nitro-phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-(2-bromophenyl)-5-[2-(4-methylphenyl)sulfanyl-5-nitro-phenyl]-1,3,4-oxadiazole Openeye Name: 2-(2-bromophenyl)-5-[5-nitro-2-(p-tolylsulfanyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-(2-bromophenyl)-5-[2-[(4-methylphenyl)thio]-5-nitrophenyl]-1,3,4-oxadiazole IUPAC Name: 2-(2-bromophenyl)-5-[2-(4-methylphenyl)sulfanyl-5-nitrophenyl]-1,3,4-oxadiazole Traditional Name: 2-(2-bromophenyl)-5-[5-nitro-2-(p-tolylthio)phenyl]-1,3,4-oxadiazole Formula: C21H14BrN3O3S MolecularWeight: 468.32316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C3=NN=C(O3)C4=CC=CC=C4Br

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C3=NN=C(O3)C4=CC=CC=C4Br

InChI

InChI=1S/C21H14BrN3O3S/c1-13-6-9-15(10-7-13)29-19-11-8-14(25(26)27)12-17(19)21-24-23-20(28-21)16-4-2-3-5-18(16)22/h2-12H,1H3