N-[2-[[4-(2-chloranyl-3-fluoranyl-phenyl)phenyl]methylamino]-4-methyl-pyridin-3-yl]-3-cyano-propanamide

Systemtic Name: N-[2-[[4-(2-chloranyl-3-fluoranyl-phenyl)phenyl]methylamino]-4-methyl-pyridin-3-yl]-3-cyano-propanamide Openeye Name: N-[2-[[4-(2-chloro-3-fluoro-phenyl)phenyl]methylamino]-4-methyl-3-pyridyl]-3-cyano-propanamide CAS Name: N-[2-[[4-(2-chloro-3-fluorophenyl)phenyl]methylamino]-4-methyl-3-pyridinyl]-3-cyanopropanamide IUPAC Name: N-[2-[[4-(2-chloro-3-fluorophenyl)phenyl]methylamino]-4-methylpyridin-3-yl]-3-cyanopropanamide Traditional Name: N-[2-[[4-(2-chloro-3-fluoro-phenyl)benzyl]amino]-4-methyl-3-pyridyl]-3-cyano-propionamide Formula: C23H20ClFN4O MolecularWeight: 422.882503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)NCC2=CC=C(C=C2)C3=C(C(=CC=C3)F)Cl)NC(=O)CCC#N

Isomeric SMILES

CC1=C(C(=NC=C1)NCC2=CC=C(C=C2)C3=C(C(=CC=C3)F)Cl)NC(=O)CCC#N

InChI

InChI=1S/C23H20ClFN4O/c1-15-11-13-27-23(22(15)29-20(30)6-3-12-26)28-14-16-7-9-17(10-8-16)18-4-2-5-19(25)21(18)24/h2,4-5,7-11,13H,3,6,14H2,1H3,(H,27,28)(H,29,30)