3-nitro-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-nitro-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(isopropylsulfamoyl)phenyl]carbamothioyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[[4-(propan-2-ylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: N-[[4-(isopropylsulfamoyl)phenyl]thiocarbamoyl]-3-nitro-benzamide Formula: C17H18N4O5S2 MolecularWeight: 422.47862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O5S2/c1-11(2)20-28(25,26)15-8-6-13(7-9-15)18-17(27)19-16(22)12-4-3-5-14(10-12)21(23)24/h3-11,20H,1-2H3,(H2,18,19,22,27)