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

Systemtic Name: 4-ethyl-5-[3-(3-methyl-4-propan-2-yl-phenoxy)propyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-ethyl-5-[3-(4-isopropyl-3-methyl-phenoxy)propyl]-1,2,4-triazole-3-thiolate CAS Name: 4-ethyl-5-[3-(3-methyl-4-propan-2-ylphenoxy)propyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-ethyl-5-[3-(3-methyl-4-propan-2-ylphenoxy)propyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-ethyl-5-[3-(4-isopropyl-3-methyl-phenoxy)propyl]-1,2,4-triazole-3-thiolate Formula: C17H24N3OS- MolecularWeight: 318.45696

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1[S-])CCCOC2=CC(=C(C=C2)C(C)C)C

Isomeric SMILES

CCN1C(=NN=C1[S-])CCCOC2=CC(=C(C=C2)C(C)C)C

InChI

InChI=1S/C17H25N3OS/c1-5-20-16(18-19-17(20)22)7-6-10-21-14-8-9-15(12(2)3)13(4)11-14/h8-9,11-12H,5-7,10H2,1-4H3,(H,19,22)/p-1