3-[4-[5-(4-fluorophenyl)-3-piperidin-4-yl-imidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazin-1-yl-benzamide

Systemtic Name: 3-[4-[5-(4-fluorophenyl)-3-piperidin-4-yl-imidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazin-1-yl-benzamide Openeye Name: 3-[4-[5-(4-fluorophenyl)-3-(4-piperidyl)imidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazin-1-yl-benzamide CAS Name: 3-[[4-[5-(4-fluorophenyl)-3-(4-piperidinyl)-4-imidazolyl]-2-pyrimidinyl]oxy]-N-(1-piperazinyl)benzamide IUPAC Name: 3-[4-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazin-1-ylbenzamide Traditional Name: 3-[4-[5-(4-fluorophenyl)-3-(4-piperidyl)imidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazino-benzamide Formula: C29H31FN8O2 MolecularWeight: 542.607243

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C=NC(=C2C3=NC(=NC=C3)OC4=CC=CC(=C4)C(=O)NN5CCNCC5)C6=CC=C(C=C6)F

Isomeric SMILES

C1CNCCC1N2C=NC(=C2C3=NC(=NC=C3)OC4=CC=CC(=C4)C(=O)NN5CCNCC5)C6=CC=C(C=C6)F

InChI

InChI=1S/C29H31FN8O2/c30-22-6-4-20(5-7-22)26-27(38(19-34-26)23-8-11-31-12-9-23)25-10-13-33-29(35-25)40-24-3-1-2-21(18-24)28(39)36-37-16-14-32-15-17-37/h1-7,10,13,18-19,23,31-32H,8-9,11-12,14-17H2,(H,36,39)