3-(azepan-1-ylsulfonyl)-N'-[2-(3-fluoranylphenoxy)ethanoyl]benzohydrazide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(3-fluoranylphenoxy)ethanoyl]benzohydrazide Openeye Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide CAS Name: 3-(1-azepanylsulfonyl)-N'-[2-(3-fluorophenoxy)-1-oxoethyl]benzohydrazide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide Traditional Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)COC3=CC(=CC=C3)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)COC3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN3O5S/c22-17-8-6-9-18(14-17)30-15-20(26)23-24-21(27)16-7-5-10-19(13-16)31(28,29)25-11-3-1-2-4-12-25/h5-10,13-14H,1-4,11-12,15H2,(H,23,26)(H,24,27)