2-(2-bromanyl-4-ethyl-phenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[(hydrocinnamoylamino)thiocarbamoyl]acetamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2)Br

InChI

InChI=1S/C20H22BrN3O3S/c1-2-14-8-10-17(16(21)12-14)27-13-19(26)22-20(28)24-23-18(25)11-9-15-6-4-3-5-7-15/h3-8,10,12H,2,9,11,13H2,1H3,(H,23,25)(H2,22,24,26,28)