3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(2-oxo-1-azepanyl)propyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-ketoazepan-1-yl)propyl]benzamide Formula: C22H32ClN3O4S MolecularWeight: 470.02518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCN3CCCCCC3=O)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCN3CCCCCC3=O)Cl

InChI

InChI=1S/C22H32ClN3O4S/c23-19-11-10-18(17-20(19)31(29,30)26-15-6-1-2-7-16-26)22(28)24-12-8-14-25-13-5-3-4-9-21(25)27/h10-11,17H,1-9,12-16H2,(H,24,28)