[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 2-fluoranyl-5-(methylsulfamoyl)benzoate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 2-fluoranyl-5-(methylsulfamoyl)benzoate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 2-fluoro-5-(methylsulfamoyl)benzoate CAS Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 2-fluoro-5-(methylsulfamoyl)benzoate Traditional Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C17H21FN2O5S MolecularWeight: 384.422443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC)F

Isomeric SMILES

CCC(CC)(C#C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC)F

InChI

InChI=1S/C17H21FN2O5S/c1-5-17(6-2,7-3)20-15(21)11-25-16(22)13-10-12(8-9-14(13)18)26(23,24)19-4/h1,8-10,19H,6-7,11H2,2-4H3,(H,20,21)