2-(4-bromanylphenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-(isonicotinamidothiocarbamoyl)acetamide Formula: C15H13BrN4O3S MolecularWeight: 409.25772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Br

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Br

InChI

InChI=1S/C15H13BrN4O3S/c16-11-1-3-12(4-2-11)23-9-13(21)18-15(24)20-19-14(22)10-5-7-17-8-6-10/h1-8H,9H2,(H,19,22)(H2,18,20,21,24)