N'-[5-nitro-6-[[3-(trifluoromethyl)phenyl]amino]pyrimidin-4-yl]benzohydrazide

Systemtic Name: N'-[5-nitro-6-[[3-(trifluoromethyl)phenyl]amino]pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]benzohydrazide CAS Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]benzohydrazide Traditional Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]benzohydrazide Formula: C18H13F3N6O3 MolecularWeight: 418.32943

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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=CC(=C3)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C18H13F3N6O3/c19-18(20,21)12-7-4-8-13(9-12)24-15-14(27(29)30)16(23-10-22-15)25-26-17(28)11-5-2-1-3-6-11/h1-10H,(H,26,28)(H2,22,23,24,25)