1-(2,6-dimethylphenyl)-5-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1,2,3,4-tetrazole

Systemtic Name: 1-(2,6-dimethylphenyl)-5-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1,2,3,4-tetrazole Openeye Name: 1-(2,6-dimethylphenyl)-5-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-tetrazole CAS Name: 1-(2,6-dimethylphenyl)-5-[(3-methyl-5-nitro-4-imidazolyl)thio]tetrazole IUPAC Name: 1-(2,6-dimethylphenyl)-5-(3-methyl-5-nitroimidazol-4-yl)sulfanyltetrazole Traditional Name: 1-(2,6-dimethylphenyl)-5-[(3-methyl-5-nitro-imidazol-4-yl)thio]tetrazole Formula: C13H13N7O2S MolecularWeight: 331.35302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SC3=C(N=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SC3=C(N=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N7O2S/c1-8-5-4-6-9(2)10(8)19-13(15-16-17-19)23-12-11(20(21)22)14-7-18(12)3/h4-7H,1-3H3