(4-fluorophenyl)methyl 3,5-bis(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: (4-fluorophenyl)methyl 3,5-bis(thiophen-2-ylsulfonylamino)benzoate Openeye Name: (4-fluorophenyl)methyl 3,5-bis(2-thienylsulfonylamino)benzoate CAS Name: 3,5-bis(thiophen-2-ylsulfonylamino)benzoic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 3,5-bis(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 3,5-bis(2-thienylsulfonylamino)benzoic acid (4-fluorobenzyl) ester Formula: C22H17FN2O6S4 MolecularWeight: 552.638583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)OCC3=CC=C(C=C3)F)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)OCC3=CC=C(C=C3)F)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H17FN2O6S4/c23-17-7-5-15(6-8-17)14-31-22(26)16-11-18(24-34(27,28)20-3-1-9-32-20)13-19(12-16)25-35(29,30)21-4-2-10-33-21/h1-13,24-25H,14H2