N6-[(2-chlorophenyl)methyl]-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[(2-chlorophenyl)methyl]-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[(2-chlorophenyl)methyl]-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[(2-chlorophenyl)methyl]-N4-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[(2-chlorophenyl)methyl]-4-N-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (2-chlorobenzyl)-[6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H13ClFN5O2 MolecularWeight: 373.768823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3F)Cl

InChI

InChI=1S/C17H13ClFN5O2/c18-12-6-2-1-5-11(12)9-20-16-15(24(25)26)17(22-10-21-16)23-14-8-4-3-7-13(14)19/h1-8,10H,9H2,(H2,20,21,22,23)