ethyl 4-[[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-phenyl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-phenyl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-benzoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluorophenyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluorobenzoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-benzoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H32FN3O5S MolecularWeight: 469.569983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)F

InChI

InChI=1S/C22H32FN3O5S/c1-4-31-22(28)25-9-7-17(8-10-25)24-21(27)19-12-18(5-6-20(19)23)32(29,30)26-13-15(2)11-16(3)14-26/h5-6,12,15-17H,4,7-11,13-14H2,1-3H3,(H,24,27)