3-(azepan-1-ylsulfonyl)-N'-(4-ethoxyphenyl)carbonyl-benzohydrazide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N'-(4-ethoxyphenyl)carbonyl-benzohydrazide Openeye Name: 3-(azepan-1-ylsulfonyl)-N'-(4-ethoxybenzoyl)benzohydrazide CAS Name: 3-(1-azepanylsulfonyl)-N'-[(4-ethoxyphenyl)-oxomethyl]benzohydrazide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N'-(4-ethoxybenzoyl)benzohydrazide Traditional Name: 3-(azepan-1-ylsulfonyl)-N'-(4-ethoxybenzoyl)benzohydrazide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H27N3O5S/c1-2-30-19-12-10-17(11-13-19)21(26)23-24-22(27)18-8-7-9-20(16-18)31(28,29)25-14-5-3-4-6-15-25/h7-13,16H,2-6,14-15H2,1H3,(H,23,26)(H,24,27)