1-(2,5-dimethylphenyl)-1,2,3,4-tetrazole-5-thiolate

Systemtic Name: 1-(2,5-dimethylphenyl)-1,2,3,4-tetrazole-5-thiolate Openeye Name: 1-(2,5-dimethylphenyl)tetrazole-5-thiolate CAS Name: 1-(2,5-dimethylphenyl)-5-tetrazolethiolate IUPAC Name: 1-(2,5-dimethylphenyl)tetrazole-5-thiolate Traditional Name: 1-(2,5-dimethylphenyl)tetrazole-5-thiolate Formula: C9H9N4S- MolecularWeight: 205.25956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=NN=N2)[S-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=NN=N2)[S-]

InChI

InChI=1S/C9H10N4S/c1-6-3-4-7(2)8(5-6)13-9(14)10-11-12-13/h3-5H,1-2H3,(H,10,12,14)/p-1