3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]benzamide

Systemtic Name: 3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]benzamide Openeye Name: 3-(1-cyano-1-methyl-ethyl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]benzamide CAS Name: 3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[[2-(5-pyrimidinyl)-4H-pyrimidin-3-yl]amino]phenyl]benzamide IUPAC Name: 3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]benzamide Traditional Name: 3-(1-cyano-1-methyl-ethyl)-N-[4-methyl-3-[[2-(5-pyrimidyl)-4H-pyrimidin-3-yl]amino]phenyl]benzamide Formula: C26H25N7O MolecularWeight: 451.523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NN3CC=CN=C3C4=CN=CN=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NN3CC=CN=C3C4=CN=CN=C4

InChI

InChI=1S/C26H25N7O/c1-18-8-9-22(31-25(34)19-6-4-7-21(12-19)26(2,3)16-27)13-23(18)32-33-11-5-10-30-24(33)20-14-28-17-29-15-20/h4-10,12-15,17,32H,11H2,1-3H3,(H,31,34)