N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]phenyl]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]phenyl]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]phenyl]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]anilino]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]phenyl]carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]phenyl]thiocarbamoyl]-2-nitro-benzamide Formula: C24H25N5O5S2 MolecularWeight: 527.6158

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O5S2/c1-3-28(4-2)19-13-9-18(10-14-19)27-36(33,34)20-15-11-17(12-16-20)25-24(35)26-23(30)21-7-5-6-8-22(21)29(31)32/h5-16,27H,3-4H2,1-2H3,(H2,25,26,30,35)