4-(2-methoxyethoxy)-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-(2-methoxyethoxy)-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-(2-methoxyethoxy)-N-[[(3-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-(2-methoxyethoxy)-N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(2-methoxyethoxy)-N-[[(3-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-(2-methoxyethoxy)-N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6S/c1-27-9-10-28-15-7-5-12(6-8-15)16(23)19-18(29)21-20-17(24)13-3-2-4-14(11-13)22(25)26/h2-8,11H,9-10H2,1H3,(H,20,24)(H2,19,21,23,29)