3,5-dinitro-N-(1,3-thiazol-2-ylcarbamothioyl)benzamide

Systemtic Name: 3,5-dinitro-N-(1,3-thiazol-2-ylcarbamothioyl)benzamide Openeye Name: 3,5-dinitro-N-(thiazol-2-ylcarbamothioyl)benzamide CAS Name: 3,5-dinitro-N-[sulfanylidene-(2-thiazolylamino)methyl]benzamide IUPAC Name: 3,5-dinitro-N-(1,3-thiazol-2-ylcarbamothioyl)benzamide Traditional Name: 3,5-dinitro-N-(thiazol-2-ylthiocarbamoyl)benzamide Formula: C11H7N5O5S2 MolecularWeight: 353.33378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=N1)NC(=S)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=N1)NC(=S)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H7N5O5S2/c17-9(13-10(22)14-11-12-1-2-23-11)6-3-7(15(18)19)5-8(4-6)16(20)21/h1-5H,(H2,12,13,14,17,22)