4-[5-[(3-chloranyl-4-fluoranyl-phenyl)amino]pyridin-3-yl]-N-(2-dimethylaminoethyl)benzamide

Systemtic Name: 4-[5-[(3-chloranyl-4-fluoranyl-phenyl)amino]pyridin-3-yl]-N-(2-dimethylaminoethyl)benzamide Openeye Name: 4-[5-(3-chloro-4-fluoro-anilino)-3-pyridyl]-N-(2-dimethylaminoethyl)benzamide CAS Name: 4-[5-(3-chloro-4-fluoroanilino)-3-pyridinyl]-N-(2-dimethylaminoethyl)benzamide IUPAC Name: 4-[5-(3-chloro-4-fluoroanilino)pyridin-3-yl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 4-[5-(3-chloro-4-fluoro-anilino)-3-pyridyl]-N-(2-dimethylaminoethyl)benzamide Formula: C22H22ClFN4O MolecularWeight: 412.887683

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC=C(C=C1)C2=CC(=CN=C2)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=CC=C(C=C1)C2=CC(=CN=C2)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C22H22ClFN4O/c1-28(2)10-9-26-22(29)16-5-3-15(4-6-16)17-11-19(14-25-13-17)27-18-7-8-21(24)20(23)12-18/h3-8,11-14,27H,9-10H2,1-2H3,(H,26,29)