1-[(4-fluorophenyl)methylsulfonyl]-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[2-(2-furylmethylcarbamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[2-[(2-furanylmethylamino)-oxomethyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzyl)sulfonyl-N-[2-(2-furfurylcarbamoyl)phenyl]isonipecotamide Formula: C25H26FN3O5S MolecularWeight: 499.554443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)S(=O)(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)S(=O)(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O5S/c26-20-9-7-18(8-10-20)17-35(32,33)29-13-11-19(12-14-29)24(30)28-23-6-2-1-5-22(23)25(31)27-16-21-4-3-15-34-21/h1-10,15,19H,11-14,16-17H2,(H,27,31)(H,28,30)