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

Systemtic Name: 4-methyl-5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,2,4-triazole-3-thiolate Openeye Name: 5-[(2-isopropyl-5-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate CAS Name: 4-methyl-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-methyl-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,2,4-triazole-3-thiolate Traditional Name: 5-[(2-isopropyl-5-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate Formula: C14H18N3OS- MolecularWeight: 276.37722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2C)[S-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2C)[S-]

InChI

InChI=1S/C14H19N3OS/c1-9(2)11-6-5-10(3)7-12(11)18-8-13-15-16-14(19)17(13)4/h5-7,9H,8H2,1-4H3,(H,16,19)/p-1