2-[(4-fluorophenyl)methylcarbamoylamino]-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]pentanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]pentanamide Openeye Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]pentanamide CAS Name: 2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]pentanamide IUPAC Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]pentanamide Traditional Name: 2-[(4-fluorobenzyl)carbamoylamino]-N-[4-(methylsulfamoylmethyl)benzyl]valeramide Formula: C22H29FN4O4S MolecularWeight: 464.553463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCC1=CC=C(C=C1)CS(=O)(=O)NC)NC(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCCC(C(=O)NCC1=CC=C(C=C1)CS(=O)(=O)NC)NC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C22H29FN4O4S/c1-3-4-20(27-22(29)26-14-17-9-11-19(23)12-10-17)21(28)25-13-16-5-7-18(8-6-16)15-32(30,31)24-2/h5-12,20,24H,3-4,13-15H2,1-2H3,(H,25,28)(H2,26,27,29)