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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(2-oxo-1-pyrrolidinyl)propyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-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=C(C=CC(=C2)C(=O)NCCCN3CCCC3=O)Cl

Isomeric SMILES

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

InChI

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