2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-chlorophenoxy)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-chloro-phenoxy)-N-(isonicotinamidothiocarbamoyl)acetamide Formula: C15H12BrClN4O3S MolecularWeight: 443.70278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C15H12BrClN4O3S/c16-10-1-2-12(11(17)7-10)24-8-13(22)19-15(25)21-20-14(23)9-3-5-18-6-4-9/h1-7H,8H2,(H,20,23)(H2,19,21,22,25)