N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]benzohydrazide

Systemtic Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]benzohydrazide Openeye Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]benzohydrazide CAS Name: N'-[3-[4-(1-azepanylsulfonyl)phenyl]-1-oxopropyl]benzohydrazide IUPAC Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]benzohydrazide Traditional Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]benzohydrazide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c26-21(23-24-22(27)19-8-4-3-5-9-19)15-12-18-10-13-20(14-11-18)30(28,29)25-16-6-1-2-7-17-25/h3-5,8-11,13-14H,1-2,6-7,12,15-17H2,(H,23,26)(H,24,27)