The Biofilms Structural Database
|
|
The Biofilms Structural Database |
BDM43138 |
|
|---|---|
6HO2 |
|
Code
GHN | |
|
Name |
ethyl 2-[4-[4-[3,3,3-tris(fluoranyl)propylsulfamoyl]phenyl]-1,3-thiazol-2-yl]ethanoate |
|
Molecular Weight |
422.44 |
|
Isomeric SMILES |
CCOC(=O)Cc1nc(cs1)c2ccc(cc2)S(=O)(=O)NCCC(F)(F)F |
|
Formula |
C16H17F3N2O4S2 |
|
Identifiers |
ethyl 2-[4-[4-[3,3,3-tris(fluoranyl)propylsulfamoyl]phenyl]-1,3-thiazol-2-yl]ethanoate |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C16H17F3N2O4S2/c1-2-25-15(22)9-14-21-13(10-26-14)11-3-5-12(6-4-11)27(23,24)20-8-7-16(17,18)19/h3-6,10,20H,2,7-9H2,1H3 |
|
Atom Count |
44 |
|
InChIKey |
BOOGQWHJJOHPJE-UHFFFAOYSA-N |
|
PDB codes |
6HO2 |
|
Type |
NON-POLYMER |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
45 |
|
Aromatic Bond Count |
11 |
|
Leaving Atoms |
n/a |