1-[4-(1-oxidanidylpyridin-1-ium-4-yl)oxyphenyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[4-(1-oxidanidylpyridin-1-ium-4-yl)oxyphenyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-(1-oxidopyridin-1-ium-4-yl)oxyphenyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]urea CAS Name: 1-[4-[(1-oxido-4-pyridin-1-iumyl)oxy]phenyl]-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-(1-oxidopyridin-1-ium-4-yl)oxyphenyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-(1-oxidopyridin-1-ium-4-yl)oxyphenyl]-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]urea Formula: C22H16F3N5O3 MolecularWeight: 455.38935

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)NC3=CC=C(C=C3)OC4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)NC3=CC=C(C=C3)OC4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C22H16F3N5O3/c23-22(24,25)15-2-7-20(30-11-1-10-26-30)19(14-15)28-21(31)27-16-3-5-17(6-4-16)33-18-8-12-29(32)13-9-18/h1-14H,(H2,27,28,31)