4-ethoxy-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-ethoxy-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-ethoxy-N-[[(3-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-ethoxy-N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethoxy-N-[[(3-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-ethoxy-N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S/c1-2-26-14-8-6-11(7-9-14)15(22)18-17(27)20-19-16(23)12-4-3-5-13(10-12)21(24)25/h3-10H,2H2,1H3,(H,19,23)(H2,18,20,22,27)