N4-cycloheptyl-N6-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-cycloheptyl-N6-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-cycloheptyl-N6-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cycloheptyl-N6-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-cycloheptyl-6-N-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: cycloheptyl-[6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H20FN5O2 MolecularWeight: 345.371403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3F

Isomeric SMILES

C1CCCC(CC1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3F

InChI

InChI=1S/C17H20FN5O2/c18-13-9-5-6-10-14(13)22-17-15(23(24)25)16(19-11-20-17)21-12-7-3-1-2-4-8-12/h5-6,9-12H,1-4,7-8H2,(H2,19,20,21,22)