2-iodanyl-N-[[(2-methylpyrazol-3-yl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-iodanyl-N-[[(2-methylpyrazol-3-yl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-iodo-N-[[(2-methylpyrazole-3-carbonyl)amino]carbamothioyl]benzamide CAS Name: 2-iodo-N-[[[(2-methyl-3-pyrazolyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-iodo-N-[[(2-methylpyrazole-3-carbonyl)amino]carbamothioyl]benzamide Traditional Name: 2-iodo-N-[[(2-methylpyrazole-3-carbonyl)amino]thiocarbamoyl]benzamide Formula: C13H12IN5O2S MolecularWeight: 429.23615

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2I

Isomeric SMILES

CN1C(=CC=N1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C13H12IN5O2S/c1-19-10(6-7-15-19)12(21)17-18-13(22)16-11(20)8-4-2-3-5-9(8)14/h2-7H,1H3,(H,17,21)(H2,16,18,20,22)