(3,5-ditert-butyl-4-oxidanyl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C23H32N4O2 MolecularWeight: 396.52578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C23H32N4O2/c1-22(2,3)17-14-16(15-18(19(17)28)23(4,5)6)20(29)26-10-12-27(13-11-26)21-24-8-7-9-25-21/h7-9,14-15,28H,10-13H2,1-6H3