The Biofilms Structural Database
Name
4-[2-(4-methylpentyl)-1,3-thiazol-4-yl]-~{N}-[3,3,3-tris(fluoranyl)propyl]benzamide
Molecular Weight
384.46
Isomeric SMILES
CC(C)CCCc1nc(cs1)c2ccc(cc2)C(=O)NCCC(F)(F)F
Formula
C19H23F3N2OS
Identifiers
Formal Charge
0
InChI
InChI=1S/C19H23F3N2OS/c1-13(2)4-3-5-17-24-16(12-26-17)14-6-8-15(9-7-14)18(25)23-11-10-19(20,21)22/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,23,25)
Atom Count
49
InChIKey
KTLILWGHLTVHAZ-UHFFFAOYSA-N
PDB codes
6HO4
Type
NON-POLYMER
Chiral Atom Count
Chiral Atoms
n/a
Bond Count
50
Aromatic Bond Count
11
Leaving Atoms