ethyl 4-[2-[ethyl-(4-fluorophenyl)sulfonyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[ethyl-(4-fluorophenyl)sulfonyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[ethyl-(4-fluorophenyl)sulfonyl-amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[ethyl-(4-fluorophenyl)sulfonylamino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[ethyl-(4-fluorophenyl)sulfonylamino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[ethyl-(4-fluorophenyl)sulfonyl-amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H24FN3O5S MolecularWeight: 401.452963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCN(CC1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCN(CC(=O)N1CCN(CC1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H24FN3O5S/c1-3-21(27(24,25)15-7-5-14(18)6-8-15)13-16(22)19-9-11-20(12-10-19)17(23)26-4-2/h5-8H,3-4,9-13H2,1-2H3