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

Systemtic Name: N-[(2-oxidanylidenethiolan-3-yl)carbamothioyl]benzamide Openeye Name: N-[(2-oxotetrahydrothiophen-3-yl)carbamothioyl]benzamide CAS Name: N-[[(2-oxo-3-thiolanyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(2-oxothiolan-3-yl)carbamothioyl]benzamide Traditional Name: N-[(2-ketotetrahydrothiophen-3-yl)thiocarbamoyl]benzamide Formula: C12H12N2O2S2 MolecularWeight: 280.36588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O2S2/c15-10(8-4-2-1-3-5-8)14-12(17)13-9-6-7-18-11(9)16/h1-5,9H,6-7H2,(H2,13,14,15,17)