2-[(3-chloranyl-2-cyano-phenyl)amino]-N-[(4-fluorophenyl)methyl]-4-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: 2-[(3-chloranyl-2-cyano-phenyl)amino]-N-[(4-fluorophenyl)methyl]-4-propan-2-yl-pyridine-3-carboxamide Openeye Name: 2-(3-chloro-2-cyano-anilino)-N-[(4-fluorophenyl)methyl]-4-isopropyl-pyridine-3-carboxamide CAS Name: 2-(3-chloro-2-cyanoanilino)-N-[(4-fluorophenyl)methyl]-4-propan-2-yl-3-pyridinecarboxamide IUPAC Name: 2-(3-chloro-2-cyanoanilino)-N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridine-3-carboxamide Traditional Name: 2-(3-chloro-2-cyano-anilino)-N-(4-fluorobenzyl)-4-isopropyl-nicotinamide Formula: C23H20ClFN4O MolecularWeight: 422.882503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NC=C1)NC2=C(C(=CC=C2)Cl)C#N)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=C(C(=NC=C1)NC2=C(C(=CC=C2)Cl)C#N)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C23H20ClFN4O/c1-14(2)17-10-11-27-22(29-20-5-3-4-19(24)18(20)12-26)21(17)23(30)28-13-15-6-8-16(25)9-7-15/h3-11,14H,13H2,1-2H3,(H,27,29)(H,28,30)