2-bromanyl-N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[oxo-[4-(1-oxopropylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[(4-propionamidobenzoyl)amino]thiocarbamoyl]benzamide Formula: C18H17BrN4O3S MolecularWeight: 449.32158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H17BrN4O3S/c1-2-15(24)20-12-9-7-11(8-10-12)16(25)22-23-18(27)21-17(26)13-5-3-4-6-14(13)19/h3-10H,2H2,1H3,(H,20,24)(H,22,25)(H2,21,23,26,27)