4-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C17H15ClN3O3S- MolecularWeight: 376.8373

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3=CC=C(C=C3)Cl)[S-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3=CC=C(C=C3)Cl)[S-]

InChI

InChI=1S/C17H16ClN3O3S/c1-22-13-8-10(9-14(23-2)15(13)24-3)16-19-20-17(25)21(16)12-6-4-11(18)5-7-12/h4-9H,1-3H3,(H,20,25)/p-1