5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-[3-(2-oxo-1-pyrrolidinyl)propyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[3-(2-ketopyrrolidino)propyl]benzamide Formula: C20H28ClN3O4S MolecularWeight: 441.97202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCCN3CCCC3=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCCN3CCCC3=O

InChI

InChI=1S/C20H28ClN3O4S/c21-18-9-8-16(29(27,28)24-13-3-1-2-4-14-24)15-17(18)20(26)22-10-6-12-23-11-5-7-19(23)25/h8-9,15H,1-7,10-14H2,(H,22,26)