4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-chloro-2,5-dimethoxy-phenyl)-5-phenyl-1,2,4-triazole-3-thiolate CAS Name: 4-(4-chloro-2,5-dimethoxyphenyl)-5-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-chloro-2,5-dimethoxyphenyl)-5-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-chloro-2,5-dimethoxy-phenyl)-5-phenyl-1,2,4-triazole-3-thiolate Formula: C16H13ClN3O2S- MolecularWeight: 346.81132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N2C(=NN=C2[S-])C3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1N2C(=NN=C2[S-])C3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C16H14ClN3O2S/c1-21-13-9-12(14(22-2)8-11(13)17)20-15(18-19-16(20)23)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,19,23)/p-1