N'-[2-(2-fluoranylphenoxy)propanoyl]-1-(phenylsulfonyl)piperidine-3-carbohydrazide

Systemtic Name: N'-[2-(2-fluoranylphenoxy)propanoyl]-1-(phenylsulfonyl)piperidine-3-carbohydrazide Openeye Name: 1-(benzenesulfonyl)-N'-[2-(2-fluorophenoxy)propanoyl]piperidine-3-carbohydrazide CAS Name: 1-(benzenesulfonyl)-N'-[2-(2-fluorophenoxy)-1-oxopropyl]-3-piperidinecarbohydrazide IUPAC Name: 1-(benzenesulfonyl)-N'-[2-(2-fluorophenoxy)propanoyl]piperidine-3-carbohydrazide Traditional Name: 1-besyl-N'-[2-(2-fluorophenoxy)propanoyl]nipecotohydrazide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)OC3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)NNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)OC3=CC=CC=C3F

InChI

InChI=1S/C21H24FN3O5S/c1-15(30-19-12-6-5-11-18(19)22)20(26)23-24-21(27)16-8-7-13-25(14-16)31(28,29)17-9-3-2-4-10-17/h2-6,9-12,15-16H,7-8,13-14H2,1H3,(H,23,26)(H,24,27)