N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: (5-bromo-2-fluoro-benzyl)-(6-morpholino-5-nitro-pyrimidin-4-yl)amine Formula: C15H15BrFN5O3 MolecularWeight: 412.213703

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=NC=N2)NCC3=C(C=CC(=C3)Br)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C(=NC=N2)NCC3=C(C=CC(=C3)Br)F)[N+](=O)[O-]

InChI

InChI=1S/C15H15BrFN5O3/c16-11-1-2-12(17)10(7-11)8-18-14-13(22(23)24)15(20-9-19-14)21-3-5-25-6-4-21/h1-2,7,9H,3-6,8H2,(H,18,19,20)