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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

InChI

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