N-[3-[[3-azanylpropyl-[3,5-bis(fluoranyl)phenyl]carbonyl-amino]methyl]-4-chloranyl-phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[[3-azanylpropyl-[3,5-bis(fluoranyl)phenyl]carbonyl-amino]methyl]-4-chloranyl-phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[[3-aminopropyl-(3,5-difluorobenzoyl)amino]methyl]-4-chloro-phenyl]pyridine-4-carboxamide CAS Name: N-[3-[[3-aminopropyl-[(3,5-difluorophenyl)-oxomethyl]amino]methyl]-4-chlorophenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[3-aminopropyl-(3,5-difluorobenzoyl)amino]methyl]-4-chlorophenyl]pyridine-4-carboxamide Traditional Name: N-[3-[[3-aminopropyl-(3,5-difluorobenzoyl)amino]methyl]-4-chloro-phenyl]isonicotinamide Formula: C23H21ClF2N4O2 MolecularWeight: 458.888246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=CC=NC=C2)CN(CCCN)C(=O)C3=CC(=CC(=C3)F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=CC=NC=C2)CN(CCCN)C(=O)C3=CC(=CC(=C3)F)F)Cl

InChI

InChI=1S/C23H21ClF2N4O2/c24-21-3-2-20(29-22(31)15-4-7-28-8-5-15)12-17(21)14-30(9-1-6-27)23(32)16-10-18(25)13-19(26)11-16/h2-5,7-8,10-13H,1,6,9,14,27H2,(H,29,31)