5-(3-ethoxy-1-ethyl-pyrazol-4-yl)-4-(2-methoxyethyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(3-ethoxy-1-ethyl-pyrazol-4-yl)-4-(2-methoxyethyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(3-ethoxy-1-ethyl-pyrazol-4-yl)-4-(2-methoxyethyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(3-ethoxy-1-ethyl-4-pyrazolyl)-4-(2-methoxyethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(3-ethoxy-1-ethylpyrazol-4-yl)-4-(2-methoxyethyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(3-ethoxy-1-ethyl-pyrazol-4-yl)-4-(2-methoxyethyl)-1,2,4-triazole-3-thiolate Formula: C12H18N5O2S- MolecularWeight: 296.36862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)OCC)C2=NN=C(N2CCOC)[S-]

Isomeric SMILES

CCN1C=C(C(=N1)OCC)C2=NN=C(N2CCOC)[S-]

InChI

InChI=1S/C12H19N5O2S/c1-4-16-8-9(11(15-16)19-5-2)10-13-14-12(20)17(10)6-7-18-3/h8H,4-7H2,1-3H3,(H,14,20)/p-1