N-[[(3S,4R)-4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioyl]benzamide

Systemtic Name: N-[[(3S,4R)-4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioyl]benzamide Openeye Name: N-[[(3S,4R)-4-chloro-1,1-dioxo-thiolan-3-yl]carbamothioyl]benzamide CAS Name: N-[[[(3S,4R)-4-chloro-1,1-dioxo-3-thiolanyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[(3S,4R)-4-chloro-1,1-dioxothiolan-3-yl]carbamothioyl]benzamide Traditional Name: N-[[(3S,4R)-4-chloro-1,1-diketo-thiolan-3-yl]thiocarbamoyl]benzamide Formula: C12H13ClN2O3S2 MolecularWeight: 332.82622

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CS1(=O)=O)Cl)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1[C@@H]([C@H](CS1(=O)=O)Cl)NC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H13ClN2O3S2/c13-9-6-20(17,18)7-10(9)14-12(19)15-11(16)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H2,14,15,16,19)/t9-,10-/m0/s1