furan-2-yl-[4-[5-nitro-6-[2,2,2-tris(fluoranyl)ethylamino]pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[5-nitro-6-[2,2,2-tris(fluoranyl)ethylamino]pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[5-nitro-6-(2,2,2-trifluoroethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[5-nitro-6-(2,2,2-trifluoroethylamino)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[5-nitro-6-(2,2,2-trifluoroethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[5-nitro-6-(2,2,2-trifluoroethylamino)pyrimidin-4-yl]piperazino]methanone Formula: C15H15F3N6O4 MolecularWeight: 400.31261

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NCC(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCC(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=CO3

InChI

InChI=1S/C15H15F3N6O4/c16-15(17,18)8-19-12-11(24(26)27)13(21-9-20-12)22-3-5-23(6-4-22)14(25)10-2-1-7-28-10/h1-2,7,9H,3-6,8H2,(H,19,20,21)