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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(4-fluoranylphenoxy)ethanoyl]benzohydrazide Openeye Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(4-fluorophenoxy)acetyl]benzohydrazide CAS Name: 3-(1-azepanylsulfonyl)-N'-[2-(4-fluorophenoxy)-1-oxoethyl]benzohydrazide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(4-fluorophenoxy)acetyl]benzohydrazide Traditional Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(4-fluorophenoxy)acetyl]benzohydrazide Formula: C21H24FN3O5S MolecularWeight: 449.495763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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