3-bromanyl-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-bromanyl-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-4-methyl-benzamide Openeye Name: 3-bromo-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-4-methyl-benzamide CAS Name: 3-bromo-N-[[4-(dipropylsulfamoyl)anilino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-bromo-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-4-methylbenzamide Traditional Name: 3-bromo-N-[[4-(dipropylsulfamoyl)phenyl]thiocarbamoyl]-4-methyl-benzamide Formula: C21H26BrN3O3S2 MolecularWeight: 512.48344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26BrN3O3S2/c1-4-12-25(13-5-2)30(27,28)18-10-8-17(9-11-18)23-21(29)24-20(26)16-7-6-15(3)19(22)14-16/h6-11,14H,4-5,12-13H2,1-3H3,(H2,23,24,26,29)