N-[[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioyl]-2-bromanyl-benzamide

Systemtic Name: N-[[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioyl]-2-bromanyl-benzamide Openeye Name: 2-bromo-N-[[(3R)-1,1-dioxothiolan-3-yl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[(3R)-1,1-dioxo-3-thiolanyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[(3R)-1,1-dioxothiolan-3-yl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[(3R)-1,1-diketothiolan-3-yl]thiocarbamoyl]benzamide Formula: C12H13BrN2O3S2 MolecularWeight: 377.27722

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

C1CS(=O)(=O)C[C@@H]1NC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C12H13BrN2O3S2/c13-10-4-2-1-3-9(10)11(16)15-12(19)14-8-5-6-20(17,18)7-8/h1-4,8H,5-7H2,(H2,14,15,16,19)/t8-/m1/s1