2-[5-(3-bromophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-[5-(3-bromophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]-1-(4-nitrophenyl)ethanone Openeye Name: 2-[5-(3-bromophenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]-1-(4-nitrophenyl)ethanone CAS Name: 2-[5-(3-bromophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]-1-(4-nitrophenyl)ethanone IUPAC Name: 2-[5-(3-bromophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]-1-(4-nitrophenyl)ethanone Traditional Name: 2-[5-(3-bromophenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]-1-(4-nitrophenyl)ethanone Formula: C16H10BrN3O4S MolecularWeight: 420.2373

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrN3O4S/c17-12-3-1-2-11(8-12)15-18-19(16(25)24-15)9-14(21)10-4-6-13(7-5-10)20(22)23/h1-8H,9H2