4-bromanyl-N-[(2-cyanoethanoylamino)carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[(2-cyanoethanoylamino)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[[(2-cyanoacetyl)amino]carbamothioyl]benzamide CAS Name: 4-bromo-N-[[(2-cyano-1-oxoethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[[(2-cyanoacetyl)amino]carbamothioyl]benzamide Traditional Name: 4-bromo-N-[[(2-cyanoacetyl)amino]thiocarbamoyl]benzamide Formula: C11H9BrN4O2S MolecularWeight: 341.18376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NNC(=O)CC#N)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NNC(=O)CC#N)Br

InChI

InChI=1S/C11H9BrN4O2S/c12-8-3-1-7(2-4-8)10(18)14-11(19)16-15-9(17)5-6-13/h1-4H,5H2,(H,15,17)(H2,14,16,18,19)