N6-(4-fluorophenyl)-N4-methyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(4-fluorophenyl)-N4-methyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N6-(4-fluorophenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-fluorophenyl)-N4-methyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-6-N-(4-fluorophenyl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-[6-(4-fluoroanilino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C18H16FN5O2 MolecularWeight: 353.350343

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)F

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN5O2/c1-23(11-13-5-3-2-4-6-13)18-16(24(25)26)17(20-12-21-18)22-15-9-7-14(19)8-10-15/h2-10,12H,11H2,1H3,(H,20,21,22)