N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[(4-methoxybenzoyl)amino]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[[(4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[[(4-methoxybenzoyl)amino]carbamothioyl]-2-nitrobenzamide Traditional Name: 2-nitro-N-[(p-anisoylamino)thiocarbamoyl]benzamide Formula: C16H14N4O5S MolecularWeight: 374.37116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O5S/c1-25-11-8-6-10(7-9-11)14(21)18-19-16(26)17-15(22)12-4-2-3-5-13(12)20(23)24/h2-9H,1H3,(H,18,21)(H2,17,19,22,26)