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

Systemtic Name: N-[3-[[2-(2-azanylpyrimidin-5-yl)-4H-pyrimidin-3-yl]amino]-4-methyl-phenyl]-3-(2-cyanopropan-2-yl)benzamide Openeye Name: N-[3-[[2-(2-aminopyrimidin-5-yl)-4H-pyrimidin-3-yl]amino]-4-methyl-phenyl]-3-(1-cyano-1-methyl-ethyl)benzamide CAS Name: N-[3-[[2-(2-amino-5-pyrimidinyl)-4H-pyrimidin-3-yl]amino]-4-methylphenyl]-3-(2-cyanopropan-2-yl)benzamide IUPAC Name: N-[3-[[2-(2-aminopyrimidin-5-yl)-4H-pyrimidin-3-yl]amino]-4-methylphenyl]-3-(2-cyanopropan-2-yl)benzamide Traditional Name: N-[3-[[2-(2-aminopyrimidin-5-yl)-4H-pyrimidin-3-yl]amino]-4-methyl-phenyl]-3-(1-cyano-1-methyl-ethyl)benzamide Formula: C26H26N8O MolecularWeight: 466.53764

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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=C(N=C4)N

Isomeric SMILES

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

InChI

InChI=1S/C26H26N8O/c1-17-8-9-21(32-24(35)18-6-4-7-20(12-18)26(2,3)16-27)13-22(17)33-34-11-5-10-29-23(34)19-14-30-25(28)31-15-19/h4-10,12-15,33H,11H2,1-3H3,(H,32,35)(H2,28,30,31)