N6-(3-chloranyl-4-fluoranyl-phenyl)-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-chloranyl-4-fluoranyl-phenyl)-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(3-chloro-4-fluoro-phenyl)-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3-chloro-4-fluorophenyl)-N4-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(3-chloro-4-fluorophenyl)-4-N-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(3-chloro-4-fluoro-anilino)-5-nitro-pyrimidin-4-yl]-(2-fluorophenyl)amine Formula: C16H10ClF2N5O2 MolecularWeight: 377.732706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)Cl)F

InChI

InChI=1S/C16H10ClF2N5O2/c17-10-7-9(5-6-11(10)18)22-15-14(24(25)26)16(21-8-20-15)23-13-4-2-1-3-12(13)19/h1-8H,(H2,20,21,22,23)