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

Systemtic Name: 3-(2-cyanopropan-2-yl)-N-[3-[[2-(5-methoxypyridin-3-yl)pyrimidin-4-yl]amino]-4-methyl-phenyl]benzamide Openeye Name: 3-(1-cyano-1-methyl-ethyl)-N-[3-[[2-(5-methoxy-3-pyridyl)pyrimidin-4-yl]amino]-4-methyl-phenyl]benzamide CAS Name: 3-(2-cyanopropan-2-yl)-N-[3-[[2-(5-methoxy-3-pyridinyl)-4-pyrimidinyl]amino]-4-methylphenyl]benzamide IUPAC Name: 3-(2-cyanopropan-2-yl)-N-[3-[[2-(5-methoxypyridin-3-yl)pyrimidin-4-yl]amino]-4-methylphenyl]benzamide Traditional Name: 3-(1-cyano-1-methyl-ethyl)-N-[3-[[2-(5-methoxy-3-pyridyl)pyrimidin-4-yl]amino]-4-methyl-phenyl]benzamide Formula: C28H26N6O2 MolecularWeight: 478.54504

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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)NC3=NC(=NC=C3)C4=CC(=CN=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC3=NC(=NC=C3)C4=CC(=CN=C4)OC

InChI

InChI=1S/C28H26N6O2/c1-18-8-9-22(32-27(35)19-6-5-7-21(12-19)28(2,3)17-29)14-24(18)33-25-10-11-31-26(34-25)20-13-23(36-4)16-30-15-20/h5-16H,1-4H3,(H,32,35)(H,31,33,34)