(phenylmethyl) 4-[4-quinoxalin-6-yl-5-[2-(trifluoromethyl)pyrimidin-4-yl]-1H-imidazol-2-yl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-quinoxalin-6-yl-5-[2-(trifluoromethyl)pyrimidin-4-yl]-1H-imidazol-2-yl]piperidine-1-carboxylate Openeye Name: benzyl 4-[4-quinoxalin-6-yl-5-[2-(trifluoromethyl)pyrimidin-4-yl]-1H-imidazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-(6-quinoxalinyl)-5-[2-(trifluoromethyl)-4-pyrimidinyl]-1H-imidazol-2-yl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-quinoxalin-6-yl-5-[2-(trifluoromethyl)pyrimidin-4-yl]-1H-imidazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-quinoxalin-6-yl-5-[2-(trifluoromethyl)pyrimidin-4-yl]-1H-imidazol-2-yl]piperidine-1-carboxylic acid benzyl ester Formula: C29H24F3N7O2 MolecularWeight: 559.54177

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=C(N2)C3=NC(=NC=C3)C(F)(F)F)C4=CC5=NC=CN=C5C=C4)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C2=NC(=C(N2)C3=NC(=NC=C3)C(F)(F)F)C4=CC5=NC=CN=C5C=C4)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C29H24F3N7O2/c30-29(31,32)27-35-11-8-22(36-27)25-24(20-6-7-21-23(16-20)34-13-12-33-21)37-26(38-25)19-9-14-39(15-10-19)28(40)41-17-18-4-2-1-3-5-18/h1-8,11-13,16,19H,9-10,14-15,17H2,(H,37,38)