N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]propanamide

Systemtic Name: N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]propanamide Openeye Name: N-[[(3-nitrobenzoyl)amino]carbamothioyl]propanamide CAS Name: N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[(3-nitrobenzoyl)amino]carbamothioyl]propanamide Traditional Name: N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]propionamide Formula: C11H12N4O4S MolecularWeight: 296.30238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N4O4S/c1-2-9(16)12-11(20)14-13-10(17)7-4-3-5-8(6-7)15(18)19/h3-6H,2H2,1H3,(H,13,17)(H2,12,14,16,20)