furan-2-yl-[4-[5-nitro-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[5-nitro-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[5-nitro-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[5-nitro-6-[[3-(trifluoromethyl)phenyl]methylamino]-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[5-nitro-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[5-nitro-6-[[3-(trifluoromethyl)benzyl]amino]pyrimidin-4-yl]piperazino]methanone Formula: C21H19F3N6O4 MolecularWeight: 476.40857

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NCC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C21H19F3N6O4/c22-21(23,24)15-4-1-3-14(11-15)12-25-18-17(30(32)33)19(27-13-26-18)28-6-8-29(9-7-28)20(31)16-5-2-10-34-16/h1-5,10-11,13H,6-9,12H2,(H,25,26,27)