5-[(2-chloranylphenoxy)methyl]-4-methyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-[(2-chloranylphenoxy)methyl]-4-methyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-(1-piperidylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-(1-piperidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-(piperidinomethyl)-1,2,4-triazole-3-thione Formula: C16H21ClN4OS MolecularWeight: 352.88214

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCCCC2)COC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCCCC2)COC3=CC=CC=C3Cl

InChI

InChI=1S/C16H21ClN4OS/c1-19-15(11-22-14-8-4-3-7-13(14)17)18-21(16(19)23)12-20-9-5-2-6-10-20/h3-4,7-8H,2,5-6,9-12H2,1H3