N2-[(4-fluorophenyl)methyl]-5-nitro-N4-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: N2-[(4-fluorophenyl)methyl]-5-nitro-N4-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N4-benzyl-N2-[(4-fluorophenyl)methyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-[(4-fluorophenyl)methyl]-5-nitro-N4-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-benzyl-2-N-[(4-fluorophenyl)methyl]-5-nitropyrimidine-2,4-diamine Traditional Name: benzyl-[2-[(4-fluorobenzyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C18H16FN5O2 MolecularWeight: 353.350343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN5O2/c19-15-8-6-14(7-9-15)11-21-18-22-12-16(24(25)26)17(23-18)20-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H2,20,21,22,23)