N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-cyano-2-fluoranyl-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-4-cyano-2-fluoro-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-4-cyano-2-fluoro-benzamide Formula: C25H20ClFN4O2 MolecularWeight: 462.903303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H20ClFN4O2/c26-21-15-19(29-24(32)20-8-6-17(16-28)14-22(20)27)7-9-23(21)30-10-12-31(13-11-30)25(33)18-4-2-1-3-5-18/h1-9,14-15H,10-13H2,(H,29,32)