4-(dimethylsulfamoyl)-N-[(5-nitro-1,3-thiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 4-(dimethylsulfamoyl)-N-[(5-nitro-1,3-thiazol-2-yl)carbamothioyl]benzamide Openeye Name: 4-(dimethylsulfamoyl)-N-[(5-nitrothiazol-2-yl)carbamothioyl]benzamide CAS Name: 4-(dimethylsulfamoyl)-N-[[(5-nitro-2-thiazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(dimethylsulfamoyl)-N-[(5-nitro-1,3-thiazol-2-yl)carbamothioyl]benzamide Traditional Name: 4-(dimethylsulfamoyl)-N-[(5-nitrothiazol-2-yl)thiocarbamoyl]benzamide Formula: C13H13N5O5S3 MolecularWeight: 415.46782

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5S3/c1-17(2)26(22,23)9-5-3-8(4-6-9)11(19)15-12(24)16-13-14-7-10(25-13)18(20)21/h3-7H,1-2H3,(H2,14,15,16,19,24)