5-[(4-tert-butylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(4-tert-butylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-tert-butylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-tert-butylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-tert-butylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(4-tert-butylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C19H20N3OS- MolecularWeight: 338.4466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)[S-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)[S-]

InChI

InChI=1S/C19H21N3OS/c1-19(2,3)14-9-11-16(12-10-14)23-13-17-20-21-18(24)22(17)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3,(H,21,24)/p-1