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

Systemtic Name: 5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-1,2,4-triazole-3-thiolate Formula: C13H16N3OS- MolecularWeight: 262.35064

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1[S-])COC2=C(C=CC=C2C)C

Isomeric SMILES

CCN1C(=NN=C1[S-])COC2=C(C=CC=C2C)C

InChI

InChI=1S/C13H17N3OS/c1-4-16-11(14-15-13(16)18)8-17-12-9(2)6-5-7-10(12)3/h5-7H,4,8H2,1-3H3,(H,15,18)/p-1