4-(cyclopropylamino)-N-[[4-(methylsulfamoyl)phenyl]methyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[[4-(methylsulfamoyl)phenyl]methyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[[4-(methylsulfamoyl)phenyl]methyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[[4-(methylsulfamoyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[[4-(methylsulfamoyl)phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[4-(methylsulfamoyl)benzyl]-3-nitro-benzamide Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5S/c1-19-28(26,27)15-7-2-12(3-8-15)11-20-18(23)13-4-9-16(21-14-5-6-14)17(10-13)22(24)25/h2-4,7-10,14,19,21H,5-6,11H2,1H3,(H,20,23)