4-methyl-5-[[4-(4-methylphenyl)phenoxy]methyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-methyl-5-[[4-(4-methylphenyl)phenoxy]methyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-methyl-5-[[4-(p-tolyl)phenoxy]methyl]-1,2,4-triazole-3-thiolate CAS Name: 4-methyl-5-[[4-(4-methylphenyl)phenoxy]methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-methyl-5-[[4-(4-methylphenyl)phenoxy]methyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-methyl-5-[[4-(p-tolyl)phenoxy]methyl]-1,2,4-triazole-3-thiolate Formula: C17H16N3OS- MolecularWeight: 310.39344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=NN=C(N3C)[S-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=NN=C(N3C)[S-]

InChI

InChI=1S/C17H17N3OS/c1-12-3-5-13(6-4-12)14-7-9-15(10-8-14)21-11-16-18-19-17(22)20(16)2/h3-10H,11H2,1-2H3,(H,19,22)/p-1