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

Systemtic Name: 4-chloranyl-3-nitro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 4-chloro-3-nitro-N-[[4-(phenethylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[[4-(phenethylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C22H19ClN4O5S2 MolecularWeight: 518.99306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O5S2/c23-19-11-6-16(14-20(19)27(29)30)21(28)26-22(33)25-17-7-9-18(10-8-17)34(31,32)24-13-12-15-4-2-1-3-5-15/h1-11,14,24H,12-13H2,(H2,25,26,28,33)