2-bromanyl-N-[[(2,6-dimethylphenyl)carbamothioylamino]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[(2,6-dimethylphenyl)carbamothioylamino]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[(2,6-dimethylphenyl)carbamothioylamino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[(2,6-dimethylanilino)-sulfanylidenemethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[(2,6-dimethylphenyl)carbamothioylamino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[(2,6-dimethylphenyl)thiocarbamoylamino]thiocarbamoyl]benzamide Formula: C17H17BrN4OS2 MolecularWeight: 437.37708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NNC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NNC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C17H17BrN4OS2/c1-10-6-5-7-11(2)14(10)19-16(24)21-22-17(25)20-15(23)12-8-3-4-9-13(12)18/h3-9H,1-2H3,(H2,19,21,24)(H2,20,22,23,25)