(4-oxidanylidene-4-thiophen-2-yl-butyl) 3-[(4-fluorophenyl)sulfamoyl]benzoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 3-[(4-fluorophenyl)sulfamoyl]benzoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 3-[(4-fluorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-fluorophenyl)sulfamoyl]benzoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 3-[(4-fluorophenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-fluorophenyl)sulfamoyl]benzoic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C21H18FNO5S2 MolecularWeight: 447.499723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)F)C(=O)OCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)F)C(=O)OCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C21H18FNO5S2/c22-16-8-10-17(11-9-16)23-30(26,27)18-5-1-4-15(14-18)21(25)28-12-2-6-19(24)20-7-3-13-29-20/h1,3-5,7-11,13-14,23H,2,6,12H2