2-bromanyl-N'-[5-nitro-6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[5-nitro-6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[5-nitro-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[5-nitro-6-[4-(trifluoromethoxy)anilino]-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[5-nitro-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[5-nitro-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzohydrazide Formula: C18H12BrF3N6O4 MolecularWeight: 513.22489

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)OC(F)(F)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)OC(F)(F)F)Br

InChI

InChI=1S/C18H12BrF3N6O4/c19-13-4-2-1-3-12(13)17(29)27-26-16-14(28(30)31)15(23-9-24-16)25-10-5-7-11(8-6-10)32-18(20,21)22/h1-9H,(H,27,29)(H2,23,24,25,26)