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

Systemtic Name: 4-(chloromethyl)-N-[4-[(4-pyridin-4-ylpyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 4-(chloromethyl)-N-[4-[[4-(4-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-(chloromethyl)-N-[4-[(4-pyridin-4-yl-2-pyrimidinyl)amino]phenyl]benzamide IUPAC Name: 4-(chloromethyl)-N-[4-[(4-pyridin-4-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 4-(chloromethyl)-N-[4-[[4-(4-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide Formula: C23H18ClN5O MolecularWeight: 415.87492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCl)C(=O)NC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC=C1CCl)C(=O)NC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=NC=C4

InChI

InChI=1S/C23H18ClN5O/c24-15-16-1-3-18(4-2-16)22(30)27-19-5-7-20(8-6-19)28-23-26-14-11-21(29-23)17-9-12-25-13-10-17/h1-14H,15H2,(H,27,30)(H,26,28,29)