4-ethyl-N-[[(4-nitrophenyl)amino]carbamothioyl]benzamide

Systemtic Name: 4-ethyl-N-[[(4-nitrophenyl)amino]carbamothioyl]benzamide Openeye Name: 4-ethyl-N-[(4-nitroanilino)carbamothioyl]benzamide CAS Name: 4-ethyl-N-[[(4-nitrophenyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethyl-N-[(4-nitroanilino)carbamothioyl]benzamide Traditional Name: 4-ethyl-N-[(4-nitroanilino)thiocarbamoyl]benzamide Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O3S/c1-2-11-3-5-12(6-4-11)15(21)17-16(24)19-18-13-7-9-14(10-8-13)20(22)23/h3-10,18H,2H2,1H3,(H2,17,19,21,24)