N4-cyclopropyl-N2-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-N2-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-N2-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-N2-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-2-N-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-5-nitropyrimidine-2,4-diamine Traditional Name: [2-[[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]amino]-1-(4-fluorophenyl)ethyl]-dimethyl-amine Formula: C17H21FN6O2 MolecularWeight: 360.386043

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=NC=C(C(=N1)NC2CC2)[N+](=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C(CNC1=NC=C(C(=N1)NC2CC2)[N+](=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C17H21FN6O2/c1-23(2)14(11-3-5-12(18)6-4-11)9-19-17-20-10-15(24(25)26)16(22-17)21-13-7-8-13/h3-6,10,13-14H,7-9H2,1-2H3,(H2,19,20,21,22)