N-[4-(azepan-1-ylsulfonyl)phenyl]-4-butan-2-yl-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-butan-2-yl-benzenesulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-sec-butyl-benzenesulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-butan-2-ylbenzenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-butan-2-ylbenzenesulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-sec-butyl-benzenesulfonamide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H30N2O4S2/c1-3-18(2)19-8-12-21(13-9-19)29(25,26)23-20-10-14-22(15-11-20)30(27,28)24-16-6-4-5-7-17-24/h8-15,18,23H,3-7,16-17H2,1-2H3