3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-ketopyrrolidino)phenyl]benzamide Formula: C23H26ClN3O4S MolecularWeight: 475.98824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)N4CCCC4=O)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)N4CCCC4=O)Cl

InChI

InChI=1S/C23H26ClN3O4S/c24-20-11-10-17(15-21(20)32(30,31)26-12-3-1-2-4-13-26)23(29)25-18-7-5-8-19(16-18)27-14-6-9-22(27)28/h5,7-8,10-11,15-16H,1-4,6,9,12-14H2,(H,25,29)