N-[(4-hydroxyphenyl)carbamothioyl]-3,5-dinitro-benzamide

Systemtic Name: N-[(4-hydroxyphenyl)carbamothioyl]-3,5-dinitro-benzamide Openeye Name: N-[(4-hydroxyphenyl)carbamothioyl]-3,5-dinitro-benzamide CAS Name: N-[(4-hydroxyanilino)-sulfanylidenemethyl]-3,5-dinitrobenzamide IUPAC Name: N-[(4-hydroxyphenyl)carbamothioyl]-3,5-dinitrobenzamide Traditional Name: N-[(4-hydroxyphenyl)thiocarbamoyl]-3,5-dinitro-benzamide Formula: C14H10N4O6S MolecularWeight: 362.3174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C14H10N4O6S/c19-12-3-1-9(2-4-12)15-14(25)16-13(20)8-5-10(17(21)22)7-11(6-8)18(23)24/h1-7,19H,(H2,15,16,20,25)