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

Systemtic Name: 5-[(4-cyclohexylphenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-cyclohexylphenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-cyclohexylphenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-cyclohexylphenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(4-cyclohexylphenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiolate Formula: C16H20N3OS- MolecularWeight: 302.4145

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1[S-])COC2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CN1C(=NN=C1[S-])COC2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C16H21N3OS/c1-19-15(17-18-16(19)21)11-20-14-9-7-13(8-10-14)12-5-3-2-4-6-12/h7-10,12H,2-6,11H2,1H3,(H,18,21)/p-1