2-(4-bromanylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[(hydrocinnamoylamino)thiocarbamoyl]acetamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrN3O3S/c19-14-7-9-15(10-8-14)25-12-17(24)20-18(26)22-21-16(23)11-6-13-4-2-1-3-5-13/h1-5,7-10H,6,11-12H2,(H,21,23)(H2,20,22,24,26)