2-[3,5-bis(bromanyl)-1,2,4-triazol-1-yl]-1-phenyl-ethanone

Systemtic Name: 2-[3,5-bis(bromanyl)-1,2,4-triazol-1-yl]-1-phenyl-ethanone Openeye Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-1-phenyl-ethanone CAS Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-1-phenylethanone IUPAC Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-1-phenylethanone Traditional Name: 2-(3,5-dibromo-1,2,4-triazol-1-yl)-1-phenyl-ethanone Formula: C10H7Br2N3O MolecularWeight: 344.99008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CN2C(=NC(=N2)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CN2C(=NC(=N2)Br)Br

InChI

InChI=1S/C10H7Br2N3O/c11-9-13-10(12)15(14-9)6-8(16)7-4-2-1-3-5-7/h1-5H,6H2