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

Systemtic Name: 4-chloranyl-N-[3-[(4-pyridin-4-ylpyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 4-chloro-N-[3-[[4-(4-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-chloro-N-[3-[(4-pyridin-4-yl-2-pyrimidinyl)amino]phenyl]benzamide IUPAC Name: 4-chloro-N-[3-[(4-pyridin-4-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 4-chloro-N-[3-[[4-(4-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide Formula: C22H16ClN5O MolecularWeight: 401.84834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16ClN5O/c23-17-6-4-16(5-7-17)21(29)26-18-2-1-3-19(14-18)27-22-25-13-10-20(28-22)15-8-11-24-12-9-15/h1-14H,(H,26,29)(H,25,27,28)