2-fluoranyl-5-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methylsulfamoyl]benzoate

Systemtic Name: 2-fluoranyl-5-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methylsulfamoyl]benzoate Openeye Name: 2-fluoro-5-[[5-(1-piperidylsulfonyl)-2-thienyl]methylsulfamoyl]benzoate CAS Name: 2-fluoro-5-[[5-(1-piperidinylsulfonyl)-2-thiophenyl]methylsulfamoyl]benzoate IUPAC Name: 2-fluoro-5-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methylsulfamoyl]benzoate Traditional Name: 2-fluoro-5-[(5-piperidinosulfonyl-2-thienyl)methylsulfamoyl]benzoate Formula: C17H18FN2O6S3- MolecularWeight: 461.528023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)[O-]

InChI

InChI=1S/C17H19FN2O6S3/c18-15-6-5-13(10-14(15)17(21)22)28(23,24)19-11-12-4-7-16(27-12)29(25,26)20-8-2-1-3-9-20/h4-7,10,19H,1-3,8-9,11H2,(H,21,22)/p-1