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

Systemtic Name: 2-[2,4-bis(bromanyl)phenoxy]-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(2,4-dibromophenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide CAS Name: 2-(2,4-dibromophenoxy)-N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,4-dibromophenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide Traditional Name: 2-(2,4-dibromophenoxy)-N-[(hydrocinnamoylamino)thiocarbamoyl]acetamide Formula: C18H17Br2N3O3S MolecularWeight: 515.21888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Br2N3O3S/c19-13-7-8-15(14(20)10-13)26-11-17(25)21-18(27)23-22-16(24)9-6-12-4-2-1-3-5-12/h1-5,7-8,10H,6,9,11H2,(H,22,24)(H2,21,23,25,27)