3,4,5-trimethoxy-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[[(4-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[[(4-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[[(4-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C18H18N4O7S MolecularWeight: 434.42312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O7S/c1-27-13-8-11(9-14(28-2)15(13)29-3)16(23)19-18(30)21-20-17(24)10-4-6-12(7-5-10)22(25)26/h4-9H,1-3H3,(H,20,24)(H2,19,21,23,30)