4-(4-chlorophenyl)-5-(2-ethyl-5-methyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-chlorophenyl)-5-(2-ethyl-5-methyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-chlorophenyl)-5-(2-ethyl-5-methyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-chlorophenyl)-5-(2-ethyl-5-methyl-3-pyrazolyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-chlorophenyl)-5-(2-ethyl-5-methylpyrazol-3-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-chlorophenyl)-5-(2-ethyl-5-methyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate Formula: C14H13ClN5S- MolecularWeight: 318.80452

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C2=NN=C(N2C3=CC=C(C=C3)Cl)[S-]

Isomeric SMILES

CCN1C(=CC(=N1)C)C2=NN=C(N2C3=CC=C(C=C3)Cl)[S-]

InChI

InChI=1S/C14H14ClN5S/c1-3-19-12(8-9(2)18-19)13-16-17-14(21)20(13)11-6-4-10(15)5-7-11/h4-8H,3H2,1-2H3,(H,17,21)/p-1