3-nitro-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 3-nitro-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridin-3-yl]benzamide Openeye Name: 3-nitro-N-[6-[3-(3-pyridyl)-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridyl]benzamide CAS Name: 3-nitro-N-[6-[3-(3-pyridinyl)-5-(trifluoromethyl)-1-pyrazolyl]-3-pyridinyl]benzamide IUPAC Name: 3-nitro-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridin-3-yl]benzamide Traditional Name: 3-nitro-N-[6-[3-(3-pyridyl)-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridyl]benzamide Formula: C21H13F3N6O3 MolecularWeight: 454.36153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CN=C(C=C2)N3C(=CC(=N3)C4=CN=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CN=C(C=C2)N3C(=CC(=N3)C4=CN=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H13F3N6O3/c22-21(23,24)18-10-17(14-4-2-8-25-11-14)28-29(18)19-7-6-15(12-26-19)27-20(31)13-3-1-5-16(9-13)30(32)33/h1-12H,(H,27,31)