N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-chloranyl-benzamide

Systemtic Name: N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-chloranyl-benzamide Openeye Name: 3-chloro-N-[[4-(sec-butylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(butan-2-ylsulfamoyl)anilino]-sulfanylidenemethyl]-3-chlorobenzamide IUPAC Name: N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-chlorobenzamide Traditional Name: 3-chloro-N-[[4-(sec-butylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C18H20ClN3O3S2 MolecularWeight: 425.9527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H20ClN3O3S2/c1-3-12(2)22-27(24,25)16-9-7-15(8-10-16)20-18(26)21-17(23)13-5-4-6-14(19)11-13/h4-12,22H,3H2,1-2H3,(H2,20,21,23,26)