2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-ethanamide Openeye Name: 2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-N-(2-cyanoethyl)-N-phenylacetamide IUPAC Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenylacetamide Traditional Name: 2-[4-(2-chloro-4-fluoro-benzyl)piperazino]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C22H24ClFN4O MolecularWeight: 414.903563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)CC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)CC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C22H24ClFN4O/c23-21-15-19(24)8-7-18(21)16-26-11-13-27(14-12-26)17-22(29)28(10-4-9-25)20-5-2-1-3-6-20/h1-3,5-8,15H,4,10-14,16-17H2