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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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