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

Systemtic Name: 4-methyl-N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-methyl-N-[[(2-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-methyl-N-[[[(2-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-methyl-N-[[(2-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-methyl-N-[[(2-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S/c1-10-6-8-11(9-7-10)14(21)17-16(25)19-18-15(22)12-4-2-3-5-13(12)20(23)24/h2-9H,1H3,(H,18,22)(H2,17,19,21,25)