The Biofilms Structural Database
Name
4-[3-(phenylsulfonylamino)prop-1-ynyl]benzenesulfonamide
Molecular Weight
350.41
Isomeric SMILES
c1ccc(cc1)S(=O)(=O)NCC#Cc2ccc(cc2)S(=O)(=O)N
Formula
C15H14N2O4S2
Identifiers
Formal Charge
0
InChI
InChI=1S/C15H14N2O4S2/c16-22(18,19)14-10-8-13(9-11-14)5-4-12-17-23(20,21)15-6-2-1-3-7-15/h1-3,6-11,17H,12H2,(H2,16,18,19)
Atom Count
37
InChIKey
CJZQAMWVHGWYBU-UHFFFAOYSA-N
PDB codes
6HOD
Type
NON-POLYMER
Chiral Atom Count
Chiral Atoms
n/a
Bond Count
38
Aromatic Bond Count
12
Leaving Atoms