(3S)-1-(4-fluorophenyl)-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)-5-oxo-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)-5-oxo-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)-5-oxo-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)-5-keto-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide Formula: C28H27FN4O3 MolecularWeight: 486.537383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)C4CC(=O)N(C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)[C@H]4CC(=O)N(C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H27FN4O3/c29-21-10-12-23(13-11-21)33-19-20(18-26(33)34)27(35)30-25-9-5-4-8-24(25)28(36)32-16-14-31(15-17-32)22-6-2-1-3-7-22/h1-13,20H,14-19H2,(H,30,35)/t20-/m0/s1