N-(5-tert-butyl-2-oxidanyl-phenyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(2-pyrimidyl)nipecotamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCCN(C2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCCN(C2)C3=NC=CC=N3

InChI

InChI=1S/C20H26N4O2/c1-20(2,3)15-7-8-17(25)16(12-15)23-18(26)14-6-4-11-24(13-14)19-21-9-5-10-22-19/h5,7-10,12,14,25H,4,6,11,13H2,1-3H3,(H,23,26)