N'-[5-nitro-6-[[3-(trifluoromethyl)phenyl]amino]pyrimidin-4-yl]naphthalene-1-carbohydrazide

Systemtic Name: N'-[5-nitro-6-[[3-(trifluoromethyl)phenyl]amino]pyrimidin-4-yl]naphthalene-1-carbohydrazide Openeye Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]naphthalene-1-carbohydrazide CAS Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]-4-pyrimidinyl]-1-naphthalenecarbohydrazide IUPAC Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]naphthalene-1-carbohydrazide Traditional Name: N'-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]naphthalene-1-carbohydrazide Formula: C22H15F3N6O3 MolecularWeight: 468.38811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NNC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NNC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H15F3N6O3/c23-22(24,25)14-7-4-8-15(11-14)28-19-18(31(33)34)20(27-12-26-19)29-30-21(32)17-10-3-6-13-5-1-2-9-16(13)17/h1-12H,(H,30,32)(H2,26,27,28,29)