N6-[(4-fluorophenyl)methyl]-5-nitro-N4-pyridin-3-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-[(4-fluorophenyl)methyl]-5-nitro-N4-pyridin-3-yl-pyrimidine-4,6-diamine Openeye Name: N6-[(4-fluorophenyl)methyl]-5-nitro-N4-(3-pyridyl)pyrimidine-4,6-diamine CAS Name: N6-[(4-fluorophenyl)methyl]-5-nitro-N4-(3-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-[(4-fluorophenyl)methyl]-5-nitro-4-N-pyridin-3-ylpyrimidine-4,6-diamine Traditional Name: (4-fluorobenzyl)-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]amine Formula: C16H13FN6O2 MolecularWeight: 340.311823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H13FN6O2/c17-12-5-3-11(4-6-12)8-19-15-14(23(24)25)16(21-10-20-15)22-13-2-1-7-18-9-13/h1-7,9-10H,8H2,(H2,19,20,21,22)