N-[(5-acetamido-2-chloranyl-phenyl)methyl]-N-(3-azanyl-2,2-dimethyl-propyl)-3-fluoranyl-benzamide

Systemtic Name: N-[(5-acetamido-2-chloranyl-phenyl)methyl]-N-(3-azanyl-2,2-dimethyl-propyl)-3-fluoranyl-benzamide Openeye Name: N-[(5-acetamido-2-chloro-phenyl)methyl]-N-(3-amino-2,2-dimethyl-propyl)-3-fluoro-benzamide CAS Name: N-[(5-acetamido-2-chlorophenyl)methyl]-N-(3-amino-2,2-dimethylpropyl)-3-fluorobenzamide IUPAC Name: N-[(5-acetamido-2-chlorophenyl)methyl]-N-(3-amino-2,2-dimethylpropyl)-3-fluorobenzamide Traditional Name: N-(5-acetamido-2-chloro-benzyl)-N-(3-amino-2,2-dimethyl-propyl)-3-fluoro-benzamide Formula: C21H25ClFN3O2 MolecularWeight: 405.893503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)Cl)CN(CC(C)(C)CN)C(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)Cl)CN(CC(C)(C)CN)C(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C21H25ClFN3O2/c1-14(27)25-18-7-8-19(22)16(10-18)11-26(13-21(2,3)12-24)20(28)15-5-4-6-17(23)9-15/h4-10H,11-13,24H2,1-3H3,(H,25,27)