N-tert-butyl-5-[[2-(4-fluoranylphenoxy)propanoylamino]carbamoyl]furan-2-sulfonamide

Systemtic Name: N-tert-butyl-5-[[2-(4-fluoranylphenoxy)propanoylamino]carbamoyl]furan-2-sulfonamide Openeye Name: N-tert-butyl-5-[[2-(4-fluorophenoxy)propanoylamino]carbamoyl]furan-2-sulfonamide CAS Name: N-tert-butyl-5-[[[2-(4-fluorophenoxy)-1-oxopropyl]hydrazo]-oxomethyl]-2-furansulfonamide IUPAC Name: N-tert-butyl-5-[[2-(4-fluorophenoxy)propanoylamino]carbamoyl]furan-2-sulfonamide Traditional Name: N-tert-butyl-5-[[2-(4-fluorophenoxy)propanoylamino]carbamoyl]furan-2-sulfonamide Formula: C18H22FN3O6S MolecularWeight: 427.447183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1=CC=C(O1)S(=O)(=O)NC(C)(C)C)OC2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)NNC(=O)C1=CC=C(O1)S(=O)(=O)NC(C)(C)C)OC2=CC=C(C=C2)F

InChI

InChI=1S/C18H22FN3O6S/c1-11(27-13-7-5-12(19)6-8-13)16(23)20-21-17(24)14-9-10-15(28-14)29(25,26)22-18(2,3)4/h5-11,22H,1-4H3,(H,20,23)(H,21,24)