3-[2-(4-chloranyl-3-methyl-phenoxy)propan-2-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(4-chloranyl-3-methyl-phenoxy)propan-2-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[1-(4-chloro-3-methyl-phenoxy)-1-methyl-ethyl]-4-isobutyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(4-chloro-3-methylphenoxy)propan-2-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(4-chloro-3-methylphenoxy)propan-2-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[1-(4-chloro-3-methyl-phenoxy)-1-methyl-ethyl]-4-isobutyl-1H-1,2,4-triazole-5-thione Formula: C16H22ClN3OS MolecularWeight: 339.88338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)(C)C2=NNC(=S)N2CC(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC(C)(C)C2=NNC(=S)N2CC(C)C)Cl

InChI

InChI=1S/C16H22ClN3OS/c1-10(2)9-20-14(18-19-15(20)22)16(4,5)21-12-6-7-13(17)11(3)8-12/h6-8,10H,9H2,1-5H3,(H,19,22)