4-(4-ethanoylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-ethanoylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-acetylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-acetylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-acetylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-acetylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C17H14N3O2S- MolecularWeight: 324.37696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H15N3O2S/c1-11(21)12-3-7-14(8-4-12)20-16(18-19-17(20)23)13-5-9-15(22-2)10-6-13/h3-10H,1-2H3,(H,19,23)/p-1