N-[3-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]-4-chloranyl-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]-4-chloranyl-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chloro-phenyl]-3-fluoro-benzamide CAS Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chlorophenyl]-3-fluorobenzamide IUPAC Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chlorophenyl]-3-fluorobenzamide Traditional Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chloro-phenyl]-3-fluoro-benzamide Formula: C22H25ClFN3O2 MolecularWeight: 417.904203

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)F)Cl)C3CCC(CC3)N

Isomeric SMILES

CC(=O)N(CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)F)Cl)C3CCC(CC3)N

InChI

InChI=1S/C22H25ClFN3O2/c1-14(28)27(20-8-5-18(25)6-9-20)13-16-12-19(7-10-21(16)23)26-22(29)15-3-2-4-17(24)11-15/h2-4,7,10-12,18,20H,5-6,8-9,13,25H2,1H3,(H,26,29)