5-[(2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate Openeye Name: 5-[(2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate CAS Name: 5-[(2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate Traditional Name: 5-[(2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate Formula: C11H12N3OS- MolecularWeight: 234.29748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2=NC(=NN2)[S-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2=NC(=NN2)[S-]

InChI

InChI=1S/C11H13N3OS/c1-7-4-3-5-8(2)10(7)15-6-9-12-11(16)14-13-9/h3-5H,6H2,1-2H3,(H2,12,13,14,16)/p-1