2-[(4-fluorophenyl)methylcarbamoylamino]-N-[3-(phenylsulfonylamino)phenyl]pentanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[3-(phenylsulfonylamino)phenyl]pentanamide Openeye Name: N-[3-(benzenesulfonamido)phenyl]-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide CAS Name: N-[3-(benzenesulfonamido)phenyl]-2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]pentanamide IUPAC Name: N-[3-(benzenesulfonamido)phenyl]-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide Traditional Name: N-[3-(benzenesulfonamido)phenyl]-2-[(4-fluorobenzyl)carbamoylamino]valeramide Formula: C25H27FN4O4S MolecularWeight: 498.569683

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCCC(C(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C25H27FN4O4S/c1-2-7-23(29-25(32)27-17-18-12-14-19(26)15-13-18)24(31)28-20-8-6-9-21(16-20)30-35(33,34)22-10-4-3-5-11-22/h3-6,8-16,23,30H,2,7,17H2,1H3,(H,28,31)(H2,27,29,32)