3-(2-chlorophenyl)-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[4-(phenylsulfamoyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[4-(phenylsulfamoyl)phenyl]thiocarbamoyl]propionamide Formula: C22H20ClN3O3S2 MolecularWeight: 473.9955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H20ClN3O3S2/c23-20-9-5-4-6-16(20)10-15-21(27)25-22(30)24-17-11-13-19(14-12-17)31(28,29)26-18-7-2-1-3-8-18/h1-9,11-14,26H,10,15H2,(H2,24,25,27,30)