N-(2,2-dimethyl-3-oxidanyl-propyl)-4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]benzamide

Systemtic Name: N-(2,2-dimethyl-3-oxidanyl-propyl)-4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]benzamide Openeye Name: N-(3-hydroxy-2,2-dimethyl-propyl)-4-methyl-3-[(3-pyrimidin-4-yl-2-pyridyl)amino]benzamide CAS Name: N-(3-hydroxy-2,2-dimethylpropyl)-4-methyl-3-[[3-(4-pyrimidinyl)-2-pyridinyl]amino]benzamide IUPAC Name: N-(3-hydroxy-2,2-dimethylpropyl)-4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]benzamide Traditional Name: N-(3-hydroxy-2,2-dimethyl-propyl)-4-methyl-3-[[3-(4-pyrimidyl)-2-pyridyl]amino]benzamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C)(C)CO)NC2=C(C=CC=N2)C3=NC=NC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(C)(C)CO)NC2=C(C=CC=N2)C3=NC=NC=C3

InChI

InChI=1S/C22H25N5O2/c1-15-6-7-16(21(29)25-12-22(2,3)13-28)11-19(15)27-20-17(5-4-9-24-20)18-8-10-23-14-26-18/h4-11,14,28H,12-13H2,1-3H3,(H,24,27)(H,25,29)