4-[[5-(dimethylamino)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-yl]amino]benzamide

Systemtic Name: 4-[[5-(dimethylamino)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[5-(dimethylamino)-4-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[5-(dimethylamino)-4-[4-(2-pyridinyl)-1-piperazinyl]-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[5-(dimethylamino)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[5-(dimethylamino)-4-[4-(2-pyridyl)piperazino]pyrimidin-2-yl]amino]benzamide Formula: C22H26N8O MolecularWeight: 418.49484

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CN=C(N=C1N2CCN(CC2)C3=CC=CC=N3)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CN(C)C1=CN=C(N=C1N2CCN(CC2)C3=CC=CC=N3)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H26N8O/c1-28(2)18-15-25-22(26-17-8-6-16(7-9-17)20(23)31)27-21(18)30-13-11-29(12-14-30)19-5-3-4-10-24-19/h3-10,15H,11-14H2,1-2H3,(H2,23,31)(H,25,26,27)