2-(4-bromanylphenoxy)-N-(hexadecylcarbamothioyl)ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-(hexadecylcarbamothioyl)ethanamide Openeye Name: 2-(4-bromophenoxy)-N-(hexadecylcarbamothioyl)acetamide CAS Name: 2-(4-bromophenoxy)-N-[(hexadecylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-(hexadecylcarbamothioyl)acetamide Traditional Name: 2-(4-bromophenoxy)-N-(cetylthiocarbamoyl)acetamide Formula: C25H41BrN2O2S MolecularWeight: 513.57424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=S)NC(=O)COC1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=S)NC(=O)COC1=CC=C(C=C1)Br

InChI

InChI=1S/C25H41BrN2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-27-25(31)28-24(29)21-30-23-18-16-22(26)17-19-23/h16-19H,2-15,20-21H2,1H3,(H2,27,28,29,31)