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

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(isonicotinamidothiocarbamoyl)acetamide Formula: C17H17BrN4O3S MolecularWeight: 437.31088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Br

InChI

InChI=1S/C17H17BrN4O3S/c1-2-11-3-4-14(13(18)9-11)25-10-15(23)20-17(26)22-21-16(24)12-5-7-19-8-6-12/h3-9H,2,10H2,1H3,(H,21,24)(H2,20,22,23,26)