N2-ethyl-N4-(4-fluorophenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-ethyl-N4-(4-fluorophenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-ethyl-N4-(4-fluorophenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-ethyl-N4-(4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-ethyl-4-N-(4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: ethyl-[4-(4-fluoroanilino)-6-methyl-5-nitro-pyrimidin-2-yl]amine Formula: C13H14FN5O2 MolecularWeight: 291.280963

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)[N+](=O)[O-])C

Isomeric SMILES

CCNC1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)[N+](=O)[O-])C

InChI

InChI=1S/C13H14FN5O2/c1-3-15-13-16-8(2)11(19(20)21)12(18-13)17-10-6-4-9(14)5-7-10/h4-7H,3H2,1-2H3,(H2,15,16,17,18)