N-[(5S)-4-oxidanylidene-3-phenethyl-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]pyridine-3-carboxamide

Systemtic Name: N-[(5S)-4-oxidanylidene-3-phenethyl-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]pyridine-3-carboxamide Openeye Name: N-[(5S)-4-oxo-3-phenethyl-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]pyridine-3-carboxamide CAS Name: N-[(5S)-4-oxo-3-phenethyl-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]-3-pyridinecarboxamide IUPAC Name: N-[(5S)-4-oxo-3-phenethyl-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]pyridine-3-carboxamide Traditional Name: N-[(4S)-5-keto-1-phenethyl-2-phenyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]nicotinamide Formula: C24H20F3N4O2+ MolecularWeight: 453.43641

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[N+]2=C(NC(C2=O)(C(F)(F)F)NC(=O)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC[N+]2=C(N[C@](C2=O)(C(F)(F)F)NC(=O)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H19F3N4O2/c25-24(26,27)23(30-21(32)19-12-7-14-28-16-19)22(33)31(15-13-17-8-3-1-4-9-17)20(29-23)18-10-5-2-6-11-18/h1-12,14,16H,13,15H2,(H,30,32)/p+1/t23-/m0/s1