dimethyl 5-[2,2,2-tris(fluoranyl)ethanoylcarbamoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[2,2,2-tris(fluoranyl)ethanoylcarbamoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(2,2,2-trifluoroacetyl)carbamoylamino]thiophene-2,4-dicarboxylate CAS Name: 5-[[oxo-[(2,2,2-trifluoro-1-oxoethyl)amino]methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2,2,2-trifluoroacetyl)carbamoylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-[(2,2,2-trifluoroacetyl)carbamoylamino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C11H9F3N2O6S MolecularWeight: 354.25917

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)NC(=O)NC(=O)C(F)(F)F)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=C(S1)NC(=O)NC(=O)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C11H9F3N2O6S/c1-21-7(17)4-3-5(8(18)22-2)23-6(4)15-10(20)16-9(19)11(12,13)14/h3H,1-2H3,(H2,15,16,19,20)