N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-2-fluoranyl-benzohydrazide

Systemtic Name: N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-2-fluoranyl-benzohydrazide Openeye Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-2-fluoro-benzohydrazide CAS Name: N'-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]-2-fluorobenzohydrazide IUPAC Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-2-fluorobenzohydrazide Traditional Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-2-fluoro-benzohydrazide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H22FN3O4S/c21-18-8-4-3-7-17(18)20(26)23-22-19(25)15-9-11-16(12-10-15)29(27,28)24-13-5-1-2-6-14-24/h3-4,7-12H,1-2,5-6,13-14H2,(H,22,25)(H,23,26)