Compound Summary


  Compound Information
 PEPA

Compound Name:

PEPA

Compound CID:

6603828

Synonyms:

PEPA

141286-78-4

2,6-Difluoro-4-2-(phenylsulfonylamino)ethylthiophenoxyacetamide

2-4-2-(benzenesulfonamido)ethylsulfanyl-2,6-difluorophenoxyacetamide

4-(2-(phenylsulfonylamino)ethylthio)-2,6-difluorophenoxyacetamide

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Iupac Name:

2-[4-[2-(benzenesulfonamido)ethylsulfanyl]-2,6-difluorophenoxy]acetamide

InChI:

InChI=1S/C16H16F2N2O4S2/c17-13-8-11(9-14(18)16(13)24-10-15(19)21)25-7-6-20-26(22,23)12-4-2-1-3-5-12/h1-5,8-9,20H,6-7,10H2,(H2,19,21)

InChIKey:

GTACSIONMHMRPD-UHFFFAOYSA-N

Canonical Smiles:

C1=CC=C(C=C1)S(=O)(=O)NCCSC2=CC(=C(C(=C2)F)OCC(=O)N)F

Isomeric Smiles:

C1=CC=C(C=C1)S(=O)(=O)NCCSC2=CC(=C(C(=C2)F)OCC(=O)N)F

Molecular Weight:

402.4

Molecular Formula:

C16H16F2N2O4S2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 PEPA

Molecular Weight:

402.4

Molecular Formula:

C16H16F2N2O4S2

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

8

Rotatable Bond Count:

9

Heavy Atom Count:

26

Complexity:

541

  Synonyms
 PEPA

  Experimental Data
 PEPA

  Experimental Data Visualization
 PEPA

  Statistics Data
 PEPA

  Statistics Data Visualization
 PEPA