N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(4-bromophenyl)sulfonyl-ethyl-amino]ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(4-bromophenyl)sulfonyl-ethyl-amino]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-ethylamino]-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-ethylamino]-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-[brosyl(ethyl)amino]-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C14H19BrN2O5S2 MolecularWeight: 439.34506

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1CCS(=O)(=O)C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrN2O5S2/c1-2-17(24(21,22)13-5-3-11(15)4-6-13)9-14(18)16-12-7-8-23(19,20)10-12/h3-6,12H,2,7-10H2,1H3,(H,16,18)/t12-/m0/s1