N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-3-nitro-benzamide Openeye Name: N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-3-nitro-benzamide CAS Name: N-[[4-(diethylsulfamoyl)anilino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-3-nitrobenzamide Traditional Name: N-[[4-(diethylsulfamoyl)phenyl]thiocarbamoyl]-3-nitro-benzamide Formula: C18H20N4O5S2 MolecularWeight: 436.5052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O5S2/c1-3-21(4-2)29(26,27)16-10-8-14(9-11-16)19-18(28)20-17(23)13-6-5-7-15(12-13)22(24)25/h5-12H,3-4H2,1-2H3,(H2,19,20,23,28)