4-ethoxy-3-nitro-N-(phenylazanylcarbamothioyl)benzamide

Systemtic Name: 4-ethoxy-3-nitro-N-(phenylazanylcarbamothioyl)benzamide Openeye Name: N-(anilinocarbamothioyl)-4-ethoxy-3-nitro-benzamide CAS Name: 4-ethoxy-3-nitro-N-[(phenylhydrazo)-sulfanylidenemethyl]benzamide IUPAC Name: N-(anilinocarbamothioyl)-4-ethoxy-3-nitrobenzamide Traditional Name: N-(anilinothiocarbamoyl)-4-ethoxy-3-nitro-benzamide Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S/c1-2-24-14-9-8-11(10-13(14)20(22)23)15(21)17-16(25)19-18-12-6-4-3-5-7-12/h3-10,18H,2H2,1H3,(H2,17,19,21,25)