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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C17H24FN3O5S/c1-3-26-17(23)20-10-8-19(9-11-20)16(22)13-21(27(2,24)25)12-14-4-6-15(18)7-5-14/h4-7H,3,8-13H2,1-2H3