N6-(4-bromophenyl)-N4-(3-chloranyl-4-fluoranyl-phenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(4-bromophenyl)-N4-(3-chloranyl-4-fluoranyl-phenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-bromophenyl)-N4-(3-chloro-4-fluoro-phenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-bromophenyl)-N4-(3-chloro-4-fluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-bromophenyl)-4-N-(3-chloro-4-fluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-bromoanilino)-5-nitro-pyrimidin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C16H10BrClFN5O2 MolecularWeight: 438.638303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C16H10BrClFN5O2/c17-9-1-3-10(4-2-9)22-15-14(24(25)26)16(21-8-20-15)23-11-5-6-13(19)12(18)7-11/h1-8H,(H2,20,21,22,23)