5-(4-chloranyl-1-methyl-pyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-chloranyl-1-methyl-pyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-chloro-1-methyl-pyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-chloro-1-methyl-3-pyrazolyl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-chloro-1-methylpyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-chloro-1-methyl-pyrazol-3-yl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C13H11ClN5OS- MolecularWeight: 320.77734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=NN=C(N2C3=CC=CC=C3OC)[S-])Cl

Isomeric SMILES

CN1C=C(C(=N1)C2=NN=C(N2C3=CC=CC=C3OC)[S-])Cl

InChI

InChI=1S/C13H12ClN5OS/c1-18-7-8(14)11(17-18)12-15-16-13(21)19(12)9-5-3-4-6-10(9)20-2/h3-7H,1-2H3,(H,16,21)/p-1