N-[2-(4-methylpiperazin-1-yl)ethyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzamide CAS Name: N-[2-(4-methyl-1-piperazinyl)ethyl]-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide Traditional Name: N-[2-(4-methylpiperazino)ethyl]-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzamide Formula: C23H27N7O MolecularWeight: 417.50678

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)C2=CC(=CC=C2)NC3=NC=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)C2=CC(=CC=C2)NC3=NC=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C23H27N7O/c1-29-12-14-30(15-13-29)11-10-25-22(31)18-4-2-6-20(16-18)27-23-26-9-7-21(28-23)19-5-3-8-24-17-19/h2-9,16-17H,10-15H2,1H3,(H,25,31)(H,26,27,28)