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

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N'-[2-(2-fluoranylphenoxy)ethanoyl]benzohydrazide Openeye Name: 4-(azepan-1-ylsulfonyl)-N'-[2-(2-fluorophenoxy)acetyl]benzohydrazide CAS Name: 4-(1-azepanylsulfonyl)-N'-[2-(2-fluorophenoxy)-1-oxoethyl]benzohydrazide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N'-[2-(2-fluorophenoxy)acetyl]benzohydrazide Traditional Name: 4-(azepan-1-ylsulfonyl)-N'-[2-(2-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=C(C=C2)C(=O)NNC(=O)COC3=CC=CC=C3F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)COC3=CC=CC=C3F

InChI

InChI=1S/C21H24FN3O5S/c22-18-7-3-4-8-19(18)30-15-20(26)23-24-21(27)16-9-11-17(12-10-16)31(28,29)25-13-5-1-2-6-14-25/h3-4,7-12H,1-2,5-6,13-15H2,(H,23,26)(H,24,27)