3-chloranyl-N-[(2-oxidanylidenethiolan-3-yl)carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-N-[(2-oxidanylidenethiolan-3-yl)carbamothioyl]benzamide Openeye Name: 3-chloro-N-[(2-oxotetrahydrothiophen-3-yl)carbamothioyl]benzamide CAS Name: 3-chloro-N-[[(2-oxo-3-thiolanyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-N-[(2-oxothiolan-3-yl)carbamothioyl]benzamide Traditional Name: 3-chloro-N-[(2-ketotetrahydrothiophen-3-yl)thiocarbamoyl]benzamide Formula: C12H11ClN2O2S2 MolecularWeight: 314.81094

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)C1NC(=S)NC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

C1CSC(=O)C1NC(=S)NC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H11ClN2O2S2/c13-8-3-1-2-7(6-8)10(16)15-12(18)14-9-4-5-19-11(9)17/h1-3,6,9H,4-5H2,(H2,14,15,16,18)