2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-oxidanyl-N-pyrimidin-2-yl-benzamide

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-oxidanyl-N-pyrimidin-2-yl-benzamide Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-5-hydroxy-N-pyrimidin-2-yl-benzamide CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-hydroxy-N-(2-pyrimidinyl)benzamide IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-hydroxy-N-pyrimidin-2-ylbenzamide Traditional Name: 2-(2,4-ditert-amylphenoxy)-5-hydroxy-N-(2-pyrimidyl)benzamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)O)C(=O)NC3=NC=CC=N3)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)O)C(=O)NC3=NC=CC=N3)C(C)(C)CC

InChI

InChI=1S/C27H33N3O3/c1-7-26(3,4)18-10-12-23(21(16-18)27(5,6)8-2)33-22-13-11-19(31)17-20(22)24(32)30-25-28-14-9-15-29-25/h9-17,31H,7-8H2,1-6H3,(H,28,29,30,32)