The Biofilms Structural Database
Name
ethyl 2-[4-[4-(3-methylbutylsulfamoyl)phenyl]-1,3-thiazol-2-yl]ethanoate
Molecular Weight
396.52
Isomeric SMILES
CCOC(=O)Cc1nc(cs1)c2ccc(cc2)S(=O)(=O)NCCC(C)C
Formula
C18H24N2O4S2
Identifiers
Formal Charge
0
InChI
InChI=1S/C18H24N2O4S2/c1-4-24-18(21)11-17-20-16(12-25-17)14-5-7-15(8-6-14)26(22,23)19-10-9-13(2)3/h5-8,12-13,19H,4,9-11H2,1-3H3
Atom Count
50
InChIKey
BNWOHTVYARXZJA-UHFFFAOYSA-N
PDB codes
6HO1
Type
NON-POLYMER
Chiral Atom Count
Chiral Atoms
n/a
Bond Count
51
Aromatic Bond Count
11
Leaving Atoms