(4-oxidanylidene-4-thiophen-2-yl-butyl) 3-(dimethylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 3-(dimethylsulfamoyl)-4-methoxy-benzoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 3-(dimethylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(dimethylsulfamoyl)-4-methoxybenzoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 3-(dimethylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(dimethylsulfamoyl)-4-methoxy-benzoic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H21NO6S2 MolecularWeight: 411.49244

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCCCC(=O)C2=CC=CS2)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCCCC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C18H21NO6S2/c1-19(2)27(22,23)17-12-13(8-9-15(17)24-3)18(21)25-10-4-6-14(20)16-7-5-11-26-16/h5,7-9,11-12H,4,6,10H2,1-3H3