N4-(4-bromophenyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(4-bromophenyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-(4-bromophenyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine CAS Name: N4-(4-bromophenyl)-5-nitro-N6-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-(4-bromophenyl)-5-nitro-6-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-5-nitro-pyrimidin-4-yl)-(4-bromophenyl)amine Formula: C16H12BrN5O2 MolecularWeight: 386.20278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN5O2/c17-11-6-8-13(9-7-11)21-16-14(22(23)24)15(18-10-19-16)20-12-4-2-1-3-5-12/h1-10H,(H2,18,19,20,21)