N-(3-bromophenyl)-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-(1-imidazolyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(3-bromophenyl)-6-imidazol-1-yl-5-nitropyrimidin-4-amine Traditional Name: (3-bromophenyl)-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)amine Formula: C13H9BrN6O2 MolecularWeight: 361.15356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C13H9BrN6O2/c14-9-2-1-3-10(6-9)18-12-11(20(21)22)13(17-7-16-12)19-5-4-15-8-19/h1-8H,(H,16,17,18)