3-[3-(2-bromanyl-4-methyl-phenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[3-(2-bromanyl-4-methyl-phenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[3-(2-bromo-4-methyl-phenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[3-(2-bromo-4-methylphenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[3-(2-bromo-4-methylphenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[3-(2-bromo-4-methyl-phenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C13H16BrN3OS MolecularWeight: 342.25464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC2=NNC(=S)N2C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC2=NNC(=S)N2C)Br

InChI

InChI=1S/C13H16BrN3OS/c1-9-5-6-11(10(14)8-9)18-7-3-4-12-15-16-13(19)17(12)2/h5-6,8H,3-4,7H2,1-2H3,(H,16,19)