N-[(4-fluorophenyl)methyl]-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[(4-fluorophenyl)methyl]-6-(4-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: N-[(4-fluorophenyl)methyl]-6-(4-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(4-fluorophenyl)methyl]-6-(4-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: (4-fluorobenzyl)-[6-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H20FN5O2 MolecularWeight: 345.371403

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NC=N2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NC=N2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H20FN5O2/c1-12-6-8-22(9-7-12)17-15(23(24)25)16(20-11-21-17)19-10-13-2-4-14(18)5-3-13/h2-5,11-12H,6-10H2,1H3,(H,19,20,21)