1-[2-nitro-5-(trifluoromethyl)phenyl]-3-[4-(2-pyridin-4-ylimidazol-1-yl)phenyl]urea

Systemtic Name: 1-[2-nitro-5-(trifluoromethyl)phenyl]-3-[4-(2-pyridin-4-ylimidazol-1-yl)phenyl]urea Openeye Name: 1-[2-nitro-5-(trifluoromethyl)phenyl]-3-[4-[2-(4-pyridyl)imidazol-1-yl]phenyl]urea CAS Name: 1-[2-nitro-5-(trifluoromethyl)phenyl]-3-[4-(2-pyridin-4-yl-1-imidazolyl)phenyl]urea IUPAC Name: 1-[2-nitro-5-(trifluoromethyl)phenyl]-3-[4-(2-pyridin-4-ylimidazol-1-yl)phenyl]urea Traditional Name: 1-[2-nitro-5-(trifluoromethyl)phenyl]-3-[4-[2-(4-pyridyl)imidazol-1-yl]phenyl]urea Formula: C22H15F3N6O3 MolecularWeight: 468.38811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)[N+](=O)[O-])N3C=CN=C3C4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)[N+](=O)[O-])N3C=CN=C3C4=CC=NC=C4

InChI

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