3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]propanamide

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]propanamide Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]propanamide CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]propanamide IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]propanamide Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]propionamide Formula: C28H43N5O2 MolecularWeight: 481.67332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C28H43N5O2/c1-27(2,3)22-19-21(20-23(25(22)35)28(4,5)6)9-10-24(34)29-13-8-14-32-15-17-33(18-16-32)26-30-11-7-12-31-26/h7,11-12,19-20,35H,8-10,13-18H2,1-6H3,(H,29,34)