3-iodanyl-4-methoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-iodo-4-methoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-iodo-4-methoxy-N-[[4-(phenylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-iodo-4-methoxy-N-[[4-(phenylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H18IN3O4S2 MolecularWeight: 567.41979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)I

InChI

InChI=1S/C21H18IN3O4S2/c1-29-19-12-7-14(13-18(19)22)20(26)24-21(30)23-15-8-10-17(11-9-15)31(27,28)25-16-5-3-2-4-6-16/h2-13,25H,1H3,(H2,23,24,26,30)