N-[4-(2-fluoranylphenoxy)phenyl]-1-[(2-propylpyrimidin-5-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[4-(2-fluoranylphenoxy)phenyl]-1-[(2-propylpyrimidin-5-yl)methyl]piperidine-4-carboxamide Openeye Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(2-propylpyrimidin-5-yl)methyl]piperidine-4-carboxamide CAS Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(2-propyl-5-pyrimidinyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(2-propylpyrimidin-5-yl)methyl]piperidine-4-carboxamide Traditional Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(2-propylpyrimidin-5-yl)methyl]isonipecotamide Formula: C26H29FN4O2 MolecularWeight: 448.532463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C=N1)CN2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4F

Isomeric SMILES

CCCC1=NC=C(C=N1)CN2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4F

InChI

InChI=1S/C26H29FN4O2/c1-2-5-25-28-16-19(17-29-25)18-31-14-12-20(13-15-31)26(32)30-21-8-10-22(11-9-21)33-24-7-4-3-6-23(24)27/h3-4,6-11,16-17,20H,2,5,12-15,18H2,1H3,(H,30,32)