4-(2-diethylphosphorylethyl)-N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide

Systemtic Name: 4-(2-diethylphosphorylethyl)-N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 4-(2-diethylphosphorylethyl)-N-[3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-(2-diethylphosphorylethyl)-N-[3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 4-(2-diethylphosphorylethyl)-N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 4-(2-diethylphosphorylethyl)-N-[3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide Formula: C28H30N5O2P MolecularWeight: 499.543861

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Descriptors Computed from Structure

Canonical SMILES:

CCP(=O)(CC)CCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CCP(=O)(CC)CCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C28H30N5O2P/c1-3-36(35,4-2)18-15-21-10-12-22(13-11-21)27(34)31-24-8-5-9-25(19-24)32-28-30-17-14-26(33-28)23-7-6-16-29-20-23/h5-14,16-17,19-20H,3-4,15,18H2,1-2H3,(H,31,34)(H,30,32,33)