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

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-[(4-fluorophenyl)methyl]-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: N-[(4-fluorophenyl)methyl]-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-[(4-fluorophenyl)methyl]-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: (4-fluorobenzyl)-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amine Formula: C15H16FN5O2 MolecularWeight: 317.318243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC=N2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC=N2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C15H16FN5O2/c16-12-5-3-11(4-6-12)9-17-14-13(21(22)23)15(19-10-18-14)20-7-1-2-8-20/h3-6,10H,1-2,7-9H2,(H,17,18,19)