N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-N-butyl-benzenesulfonamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-N-butyl-benzenesulfonamide Openeye Name: 4-bromo-N-butyl-N-[(3S)-1,1-dioxothiolan-3-yl]benzenesulfonamide CAS Name: 4-bromo-N-butyl-N-[(3S)-1,1-dioxo-3-thiolanyl]benzenesulfonamide IUPAC Name: 4-bromo-N-butyl-N-[(3S)-1,1-dioxothiolan-3-yl]benzenesulfonamide Traditional Name: 4-bromo-N-butyl-N-[(3S)-1,1-diketothiolan-3-yl]benzenesulfonamide Formula: C14H20BrNO4S2 MolecularWeight: 410.3469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCN([C@H]1CCS(=O)(=O)C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H20BrNO4S2/c1-2-3-9-16(13-8-10-21(17,18)11-13)22(19,20)14-6-4-12(15)5-7-14/h4-7,13H,2-3,8-11H2,1H3/t13-/m0/s1