2-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide CAS Name: 2-bromo-N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide Traditional Name: 2-bromo-N-[(3-ethoxypropanoylamino)thiocarbamoyl]benzamide Formula: C13H16BrN3O3S MolecularWeight: 374.25344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(=O)NNC(=S)NC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CCOCCC(=O)NNC(=S)NC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C13H16BrN3O3S/c1-2-20-8-7-11(18)16-17-13(21)15-12(19)9-5-3-4-6-10(9)14/h3-6H,2,7-8H2,1H3,(H,16,18)(H2,15,17,19,21)