[4-[6-(4-bromanyl-2-fluoranyl-phenoxy)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-[6-(4-bromanyl-2-fluoranyl-phenoxy)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-[6-(4-bromo-2-fluoro-phenoxy)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-[6-(4-bromo-2-fluorophenoxy)-5-nitro-4-pyrimidinyl]-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-[6-(4-bromo-2-fluorophenoxy)-5-nitropyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[6-(4-bromo-2-fluoro-phenoxy)-5-nitro-pyrimidin-4-yl]piperazino]-(2-furyl)methanone Formula: C19H15BrFN5O5 MolecularWeight: 492.255303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)OC3=C(C=C(C=C3)Br)F)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)OC3=C(C=C(C=C3)Br)F)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C19H15BrFN5O5/c20-12-3-4-14(13(21)10-12)31-18-16(26(28)29)17(22-11-23-18)24-5-7-25(8-6-24)19(27)15-2-1-9-30-15/h1-4,9-11H,5-8H2