N-[[(4-hydroxyphenyl)carbonylamino]carbamothioyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[[(4-hydroxyphenyl)carbonylamino]carbamothioyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[[(4-hydroxybenzoyl)amino]carbamothioyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[[[(4-hydroxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[[(4-hydroxybenzoyl)amino]carbamothioyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[[(4-hydroxybenzoyl)amino]thiocarbamoyl]-4-methoxy-3-nitro-benzamide Formula: C16H14N4O6S MolecularWeight: 390.37056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O6S/c1-26-13-7-4-10(8-12(13)20(24)25)14(22)17-16(27)19-18-15(23)9-2-5-11(21)6-3-9/h2-8,21H,1H3,(H,18,23)(H2,17,19,22,27)