ethyl 4-[5-(4-fluorophenyl)thiophen-2-yl]sulfonyl-3-(oxidanylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(4-fluorophenyl)thiophen-2-yl]sulfonyl-3-(oxidanylcarbamoyl)piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(4-fluorophenyl)-2-thienyl]sulfonyl]-3-(hydroxycarbamoyl)piperazine-1-carboxylate CAS Name: 4-[[5-(4-fluorophenyl)-2-thiophenyl]sulfonyl]-3-[(hydroxyamino)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-fluorophenyl)thiophen-2-yl]sulfonyl-3-(hydroxycarbamoyl)piperazine-1-carboxylate Traditional Name: 4-[[5-(4-fluorophenyl)-2-thienyl]sulfonyl]-3-(hydroxycarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C18H20FN3O6S2 MolecularWeight: 457.496303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O6S2/c1-2-28-18(24)21-9-10-22(14(11-21)17(23)20-25)30(26,27)16-8-7-15(29-16)12-3-5-13(19)6-4-12/h3-8,14,25H,2,9-11H2,1H3,(H,20,23)