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

Systemtic Name: 2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]pyridine-4-carboxamide Openeye Name: 2-(1-cyano-1-methyl-ethyl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]pyridine-4-carboxamide CAS Name: 2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[[2-(5-pyrimidinyl)-4H-pyrimidin-3-yl]amino]phenyl]-4-pyridinecarboxamide IUPAC Name: 2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(2-pyrimidin-5-yl-4H-pyrimidin-3-yl)amino]phenyl]pyridine-4-carboxamide Traditional Name: 2-(1-cyano-1-methyl-ethyl)-N-[4-methyl-3-[[2-(5-pyrimidyl)-4H-pyrimidin-3-yl]amino]phenyl]isonicotinamide Formula: C25H24N8O MolecularWeight: 452.51106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N8O/c1-17-5-6-20(31-24(34)18-7-9-29-22(11-18)25(2,3)15-26)12-21(17)32-33-10-4-8-30-23(33)19-13-27-16-28-14-19/h4-9,11-14,16,32H,10H2,1-3H3,(H,31,34)