5-[(4-bromanyl-2,6-dimethyl-phenoxy)methyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[(4-bromanyl-2,6-dimethyl-phenoxy)methyl]-1H-1,2,4-triazol-3-amine Openeye Name: 5-[(4-bromo-2,6-dimethyl-phenoxy)methyl]-1H-1,2,4-triazol-3-amine CAS Name: 5-[(4-bromo-2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[(4-bromo-2,6-dimethylphenoxy)methyl]-1H-1,2,4-triazol-3-amine Traditional Name: [5-[(4-bromo-2,6-dimethyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]amine Formula: C11H13BrN4O MolecularWeight: 297.15112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=NC(=NN2)N)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=NC(=NN2)N)C)Br

InChI

InChI=1S/C11H13BrN4O/c1-6-3-8(12)4-7(2)10(6)17-5-9-14-11(13)16-15-9/h3-4H,5H2,1-2H3,(H3,13,14,15,16)