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

Systemtic Name: N6-[(4-fluorophenyl)methyl]-5-nitro-N4-quinolin-5-yl-pyrimidine-4,6-diamine Openeye Name: N6-[(4-fluorophenyl)methyl]-5-nitro-N4-(5-quinolyl)pyrimidine-4,6-diamine CAS Name: N6-[(4-fluorophenyl)methyl]-5-nitro-N4-(5-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-[(4-fluorophenyl)methyl]-5-nitro-4-N-quinolin-5-ylpyrimidine-4,6-diamine Traditional Name: (4-fluorobenzyl)-[5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]amine Formula: C20H15FN6O2 MolecularWeight: 390.370503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)NCC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)NCC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H15FN6O2/c21-14-8-6-13(7-9-14)11-23-19-18(27(28)29)20(25-12-24-19)26-17-5-1-4-16-15(17)3-2-10-22-16/h1-10,12H,11H2,(H2,23,24,25,26)