[4-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]-3-nitro-phenyl]-phenyl-methanone Formula: C21H12BrN3O4S MolecularWeight: 482.30668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)SC3=NN=C(O3)C4=CC=CC=C4Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)SC3=NN=C(O3)C4=CC=CC=C4Br)[N+](=O)[O-]

InChI

InChI=1S/C21H12BrN3O4S/c22-16-9-5-4-8-15(16)20-23-24-21(29-20)30-18-11-10-14(12-17(18)25(27)28)19(26)13-6-2-1-3-7-13/h1-12H