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

Systemtic Name: 5-(4-methoxyphenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-methoxyphenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-methoxyphenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-methoxyphenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-methoxyphenyl)-4-(4-phenoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C21H16N3O2S- MolecularWeight: 374.43564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC4=CC=CC=C4)[S-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC4=CC=CC=C4)[S-]

InChI

InChI=1S/C21H17N3O2S/c1-25-17-11-7-15(8-12-17)20-22-23-21(27)24(20)16-9-13-19(14-10-16)26-18-5-3-2-4-6-18/h2-14H,1H3,(H,23,27)/p-1