(3S)-1-(3-bromophenyl)-3-thiomorpholin-4-ium-4-yl-pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-(3-bromophenyl)-3-thiomorpholin-4-ium-4-yl-pyrrolidine-2,5-dione Openeye Name: (3S)-1-(3-bromophenyl)-3-thiomorpholin-4-ium-4-yl-pyrrolidine-2,5-dione CAS Name: (3S)-1-(3-bromophenyl)-3-(4-thiomorpholin-4-iumyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-1-(3-bromophenyl)-3-thiomorpholin-4-ium-4-ylpyrrolidine-2,5-dione Traditional Name: (3S)-1-(3-bromophenyl)-3-thiomorpholin-4-ium-4-yl-pyrrolidine-2,5-quinone Formula: C14H16BrN2O2S+ MolecularWeight: 356.25804

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1C2CC(=O)N(C2=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CSCC[NH+]1[C@H]2CC(=O)N(C2=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C14H15BrN2O2S/c15-10-2-1-3-11(8-10)17-13(18)9-12(14(17)19)16-4-6-20-7-5-16/h1-3,8,12H,4-7,9H2/p+1/t12-/m0/s1