1-[2-chloranyl-5-(4-piperazin-1-ylphenyl)phenyl]-N-(cyanomethyl)-4,4-bis(fluoranyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[2-chloranyl-5-(4-piperazin-1-ylphenyl)phenyl]-N-(cyanomethyl)-4,4-bis(fluoranyl)pyrrolidine-2-carboxamide Openeye Name: 1-[2-chloro-5-(4-piperazin-1-ylphenyl)phenyl]-N-(cyanomethyl)-4,4-difluoro-pyrrolidine-2-carboxamide CAS Name: 1-[2-chloro-5-[4-(1-piperazinyl)phenyl]phenyl]-N-(cyanomethyl)-4,4-difluoro-2-pyrrolidinecarboxamide IUPAC Name: 1-[2-chloro-5-(4-piperazin-1-ylphenyl)phenyl]-N-(cyanomethyl)-4,4-difluoropyrrolidine-2-carboxamide Traditional Name: 1-[2-chloro-5-(4-piperazinophenyl)phenyl]-N-(cyanomethyl)-4,4-difluoro-pyrrolidine-2-carboxamide Formula: C23H24ClF2N5O MolecularWeight: 459.919366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=C(C=C2)C3=CC(=C(C=C3)Cl)N4CC(CC4C(=O)NCC#N)(F)F

Isomeric SMILES

C1CN(CCN1)C2=CC=C(C=C2)C3=CC(=C(C=C3)Cl)N4CC(CC4C(=O)NCC#N)(F)F

InChI

InChI=1S/C23H24ClF2N5O/c24-19-6-3-17(16-1-4-18(5-2-16)30-11-9-28-10-12-30)13-20(19)31-15-23(25,26)14-21(31)22(32)29-8-7-27/h1-6,13,21,28H,8-12,14-15H2,(H,29,32)