5-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-4-(4-ethoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-4-(4-ethoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-4-(4-ethoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-chloro-2,5-dimethyl-3-pyrazolyl)-4-(4-ethoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-chloro-2,5-dimethylpyrazol-3-yl)-4-(4-ethoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-4-p-phenetyl-1,2,4-triazole-3-thiolate Formula: C15H15ClN5OS- MolecularWeight: 348.8305

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2[S-])C3=C(C(=NN3C)C)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2[S-])C3=C(C(=NN3C)C)Cl

InChI

InChI=1S/C15H16ClN5OS/c1-4-22-11-7-5-10(6-8-11)21-14(17-18-15(21)23)13-12(16)9(2)19-20(13)3/h5-8H,4H2,1-3H3,(H,18,23)/p-1