N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-[butyl(ethyl)amino]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-[butyl(ethyl)amino]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-[butyl(ethyl)amino]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-chlorophenyl]-2-[butyl(ethyl)amino]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-2-[butyl(ethyl)amino]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-[butyl(ethyl)amino]acetamide Formula: C20H32ClN3O3S MolecularWeight: 430.00438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Cl

Isomeric SMILES

CCCCN(CC)CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Cl

InChI

InChI=1S/C20H32ClN3O3S/c1-3-5-12-23(4-2)16-20(25)22-19-15-17(10-11-18(19)21)28(26,27)24-13-8-6-7-9-14-24/h10-11,15H,3-9,12-14,16H2,1-2H3,(H,22,25)