![spacer](http://www.ebi.ac.uk/inc/images/spacer.gif) |
L7T : Summary
Code ![](/pdbe/static/images/help.png)
|
L7T
|
One-letter code ![](/pdbe/static/images/help.png)
|
X
|
Molecule name ![](/pdbe/static/images/help.png)
|
2,3,4,5,6-pentafluorobenzenesulfonamide
|
Systematic names ![](/pdbe/static/images/help.png)
|
|
Formula ![](/pdbe/static/images/help.png)
|
C6 H2 F5 N O2 S
|
Formal charge ![](/pdbe/static/images/help.png)
|
0
|
Molecular weight ![](/pdbe/static/images/help.png)
|
247.143 Da
|
SMILES ![](/pdbe/static/images/help.png)
|
Type | Program | Version | Descriptor |
SMILES
|
CACTVS |
3.385 |
N[S](=O)(=O)c1c(F)c(F)c(F)c(F)c1F |
SMILES
|
OpenEye OEToolkits |
2.0.7 |
c1(c(c(c(c(c1F)F)S(=O)(=O)N)F)F)F |
Canonical SMILES
|
CACTVS |
3.385 |
N[S](=O)(=O)c1c(F)c(F)c(F)c(F)c1F |
Canonical SMILES
|
OpenEye OEToolkits |
2.0.7 |
c1(c(c(c(c(c1F)F)S(=O)(=O)N)F)F)F |
|
IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C6H2F5NO2S/c7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9/h(H2,12,13,14) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | ZWVYQZBCSXCUOO-UHFFFAOYSA-N |
|
wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
|
17 (15 without Hydrogen)
|
Polymer type ![](/pdbe/static/images/help.png)
|
Bound ligand
|
Type description ![](/pdbe/static/images/help.png)
|
NON-POLYMER
|
Type code ![](/pdbe/static/images/help.png)
|
HETAIN
|
Is modified ![](/pdbe/static/images/help.png)
|
No
|
Standard parent ![](/pdbe/static/images/help.png)
|
Not Assigned
|
Defined at ![](/pdbe/static/images/help.png)
|
2019-07-26
|
Last modified at ![](/pdbe/static/images/help.png)
|
2020-04-10
|
Status ![](/pdbe/static/images/help.png)
|
Released
|
Obsoleted ![](/pdbe/static/images/help.png)
|
Not Assigned
|
|