3,5-dinitro-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3,5-dinitro-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 3,5-dinitro-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3,5-dinitro-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3,5-dinitro-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide Formula: C14H9N5O7S2 MolecularWeight: 423.38056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)N)SC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)N)SC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O7S2/c15-28(25,26)10-1-2-11-12(6-10)27-14(16-11)17-13(20)7-3-8(18(21)22)5-9(4-7)19(23)24/h1-6H,(H2,15,25,26)(H,16,17,20)