5-bromanyl-N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide

Systemtic Name: 5-bromanyl-N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide Openeye Name: 5-bromo-2-(2-methoxyethoxy)-N-[[4-(sec-butylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-N-[[4-(butan-2-ylsulfamoyl)anilino]-sulfanylidenemethyl]-2-(2-methoxyethoxy)benzamide IUPAC Name: 5-bromo-N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide Traditional Name: 5-bromo-2-(2-methoxyethoxy)-N-[[4-(sec-butylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H26BrN3O5S2 MolecularWeight: 544.48224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26BrN3O5S2/c1-4-14(2)25-32(27,28)17-8-6-16(7-9-17)23-21(31)24-20(26)18-13-15(22)5-10-19(18)30-12-11-29-3/h5-10,13-14,25H,4,11-12H2,1-3H3,(H2,23,24,26,31)