5-[(1-methyl-5-nitro-imidazol-2-yl)-sulfonyl-methyl]-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(1-methyl-5-nitro-imidazol-2-yl)-sulfonyl-methyl]-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[(1-methyl-5-nitro-imidazol-2-yl)-sulfonyl-methyl]-1-phenyl-tetrazole CAS Name: 5-[(1-methyl-5-nitro-2-imidazolyl)-sulfonylmethyl]-1-phenyltetrazole IUPAC Name: 5-[(1-methyl-5-nitroimidazol-2-yl)-sulfonylmethyl]-1-phenyltetrazole Traditional Name: 5-[(1-methyl-5-nitro-imidazol-2-yl)-sulfonyl-methyl]-1-phenyl-tetrazole Formula: C12H9N7O4S MolecularWeight: 347.30936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C(=S(=O)=O)C2=NN=NN2C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C(=S(=O)=O)C2=NN=NN2C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N7O4S/c1-17-9(19(20)21)7-13-11(17)10(24(22)23)12-14-15-16-18(12)8-5-3-2-4-6-8/h2-7H,1H3