5-[(2,6-dimethylphenoxy)methyl]-N-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(2,6-dimethylphenoxy)methyl]-N-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[(2,6-dimethylphenoxy)methyl]-N-[[(3R)-1-pyrimidin-2-yl-3-piperidyl]methyl]isoxazole-3-carboxamide CAS Name: 5-[(2,6-dimethylphenoxy)methyl]-N-[[(3R)-1-(2-pyrimidinyl)-3-piperidinyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(2,6-dimethylphenoxy)methyl]-N-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[(2,6-dimethylphenoxy)methyl]-N-[[(3R)-1-(2-pyrimidyl)-3-piperidyl]methyl]isoxazole-3-carboxamide Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2=CC(=NO2)C(=O)NCC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2=CC(=NO2)C(=O)NC[C@H]3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C23H27N5O3/c1-16-6-3-7-17(2)21(16)30-15-19-12-20(27-31-19)22(29)26-13-18-8-4-11-28(14-18)23-24-9-5-10-25-23/h3,5-7,9-10,12,18H,4,8,11,13-15H2,1-2H3,(H,26,29)/t18-/m1/s1