N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-3-(2-methylpropoxy)benzamide Openeye Name: 3-isobutoxy-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]benzamide CAS Name: N-[4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl]-3-(2-methylpropoxy)benzamide Traditional Name: 3-isobutoxy-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]benzamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC(C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O2/c1-19(2)18-34-25-11-7-10-22(16-25)28(33)32-24-14-12-23(13-15-24)31-27-17-26(29-20(3)30-27)21-8-5-4-6-9-21/h4-17,19H,18H2,1-3H3,(H,32,33)(H,29,30,31)