N4-(3-bromophenyl)-N6-(3-chlorophenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(3-bromophenyl)-N6-(3-chlorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(3-bromophenyl)-N6-(3-chlorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(3-bromophenyl)-N6-(3-chlorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(3-bromophenyl)-6-N-(3-chlorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(3-bromoanilino)-5-nitro-pyrimidin-4-yl]-(3-chlorophenyl)amine Formula: C16H11BrClN5O2 MolecularWeight: 420.64784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrClN5O2/c17-10-3-1-5-12(7-10)21-15-14(23(24)25)16(20-9-19-15)22-13-6-2-4-11(18)8-13/h1-9H,(H2,19,20,21,22)