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

Systemtic Name: 5-[(4-ethoxyphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-ethoxyphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-ethoxyphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-ethoxyphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate Traditional Name: 5-[(4-ethoxyphenoxy)methyl]-1H-1,2,4-triazole-3-thiolate Formula: C11H12N3O2S- MolecularWeight: 250.29688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC2=NC(=NN2)[S-]

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC2=NC(=NN2)[S-]

InChI

InChI=1S/C11H13N3O2S/c1-2-15-8-3-5-9(6-4-8)16-7-10-12-11(17)14-13-10/h3-6H,2,7H2,1H3,(H2,12,13,14,17)/p-1