[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolidinylsulfonyl)-2-thiophenecarboxylic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-pyrrolidinosulfonylthiophene-2-carboxylic acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C17H17FN2O5S2 MolecularWeight: 412.455683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(SC=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(SC=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C17H17FN2O5S2/c18-12-4-3-5-13(10-12)19-15(21)11-25-17(22)16-14(6-9-26-16)27(23,24)20-7-1-2-8-20/h3-6,9-10H,1-2,7-8,11H2,(H,19,21)