3-bromanyl-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[[4-(diethylsulfamoyl)anilino]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[[4-(diethylsulfamoyl)phenyl]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C21H26BrN3O5S2 MolecularWeight: 544.48224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26BrN3O5S2/c1-4-25(5-2)32(27,28)17-9-7-16(8-10-17)23-21(31)24-20(26)15-6-11-19(18(22)14-15)30-13-12-29-3/h6-11,14H,4-5,12-13H2,1-3H3,(H2,23,24,26,31)