5-(4-chloranyl-1-ethyl-pyrazol-3-yl)-4-(4-sulfamoylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-chloranyl-1-ethyl-pyrazol-3-yl)-4-(4-sulfamoylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-chloro-1-ethyl-pyrazol-3-yl)-4-(4-sulfamoylphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-chloro-1-ethyl-3-pyrazolyl)-4-(4-sulfamoylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-chloro-1-ethylpyrazol-3-yl)-4-(4-sulfamoylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-chloro-1-ethyl-pyrazol-3-yl)-4-(4-sulfamoylphenyl)-1,2,4-triazole-3-thiolate Formula: C13H12ClN6O2S2- MolecularWeight: 383.85638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN6O2S2/c1-2-19-7-10(14)11(18-19)12-16-17-13(23)20(12)8-3-5-9(6-4-8)24(15,21)22/h3-7H,2H2,1H3,(H,17,23)(H2,15,21,22)/p-1