5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(2-isopropyl-5-methyl-phenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(2-isopropyl-5-methyl-phenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C19H20N3OS- MolecularWeight: 338.4466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2C3=CC=CC=C3)[S-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2C3=CC=CC=C3)[S-]

InChI

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