5-(azepan-1-ylsulfonyl)-N-[2-(butylcarbamoyl)phenyl]-2-chloranyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-(butylcarbamoyl)phenyl]-2-chloranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(butylcarbamoyl)phenyl]-2-chloro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-[butylamino(oxo)methyl]phenyl]-2-chlorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(butylcarbamoyl)phenyl]-2-chlorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(butylcarbamoyl)phenyl]-2-chloro-benzamide Formula: C24H30ClN3O4S MolecularWeight: 492.0307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C24H30ClN3O4S/c1-2-3-14-26-23(29)19-10-6-7-11-22(19)27-24(30)20-17-18(12-13-21(20)25)33(31,32)28-15-8-4-5-9-16-28/h6-7,10-13,17H,2-5,8-9,14-16H2,1H3,(H,26,29)(H,27,30)