N-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-[(2-benzyloxy-5-bromo-phenyl)methyl]-1H-1,2,4-triazol-5-amine CAS Name: N-[(5-bromo-2-phenylmethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(5-bromo-2-phenylmethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Traditional Name: (2-benzoxy-5-bromo-benzyl)-(1H-1,2,4-triazol-5-yl)amine Formula: C16H15BrN4O MolecularWeight: 359.2205

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CNC3=NC=NN3

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CNC3=NC=NN3

InChI

InChI=1S/C16H15BrN4O/c17-14-6-7-15(22-10-12-4-2-1-3-5-12)13(8-14)9-18-16-19-11-20-21-16/h1-8,11H,9-10H2,(H2,18,19,20,21)