[1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(pyrimidin-2-ylamino)ethyl] 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(2-fluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid [1-oxo-1-(2-pyrimidinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(pyrimidin-2-ylamino)propan-2-yl] 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylic acid [2-keto-1-methyl-2-(2-pyrimidylamino)ethyl] ester Formula: C18H19FN4O5S MolecularWeight: 422.430663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=CC=N1)OC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)NC1=NC=CC=N1)OC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H19FN4O5S/c1-12(16(24)22-18-20-9-5-10-21-18)28-17(25)14-7-4-11-23(14)29(26,27)15-8-3-2-6-13(15)19/h2-3,5-6,8-10,12,14H,4,7,11H2,1H3,(H,20,21,22,24)