2,2-dimethyl-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[[(4-nitrobenzoyl)amino]carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[(4-nitrobenzoyl)amino]carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[[(4-nitrobenzoyl)amino]thiocarbamoyl]propionamide Formula: C13H16N4O4S MolecularWeight: 324.35554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4S/c1-13(2,3)11(19)14-12(22)16-15-10(18)8-4-6-9(7-5-8)17(20)21/h4-7H,1-3H3,(H,15,18)(H2,14,16,19,22)