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

Systemtic Name: 4-methyl-N-[(2-oxidanylidenethiolan-3-yl)carbamothioyl]benzamide Openeye Name: 4-methyl-N-[(2-oxotetrahydrothiophen-3-yl)carbamothioyl]benzamide CAS Name: 4-methyl-N-[[(2-oxo-3-thiolanyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-methyl-N-[(2-oxothiolan-3-yl)carbamothioyl]benzamide Traditional Name: N-[(2-ketotetrahydrothiophen-3-yl)thiocarbamoyl]-4-methyl-benzamide Formula: C13H14N2O2S2 MolecularWeight: 294.39246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2CCSC2=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2CCSC2=O

InChI

InChI=1S/C13H14N2O2S2/c1-8-2-4-9(5-3-8)11(16)15-13(18)14-10-6-7-19-12(10)17/h2-5,10H,6-7H2,1H3,(H2,14,15,16,18)