tert-butyl 4-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)imidazol-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)imidazol-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)imidazol-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-(4-fluorophenyl)-5-(2-phenoxy-4-pyrimidinyl)-1-imidazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)imidazol-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)imidazol-1-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H30FN5O3 MolecularWeight: 515.578603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C=NC(=C2C3=NC(=NC=C3)OC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C=NC(=C2C3=NC(=NC=C3)OC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H30FN5O3/c1-29(2,3)38-28(36)34-17-14-22(15-18-34)35-19-32-25(20-9-11-21(30)12-10-20)26(35)24-13-16-31-27(33-24)37-23-7-5-4-6-8-23/h4-13,16,19,22H,14-15,17-18H2,1-3H3