2-(2-bromanyl-4-methyl-phenoxy)-N-(hexadecylcarbamothioyl)ethanamide

Systemtic Name: 2-(2-bromanyl-4-methyl-phenoxy)-N-(hexadecylcarbamothioyl)ethanamide Openeye Name: 2-(2-bromo-4-methyl-phenoxy)-N-(hexadecylcarbamothioyl)acetamide CAS Name: 2-(2-bromo-4-methylphenoxy)-N-[(hexadecylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-methylphenoxy)-N-(hexadecylcarbamothioyl)acetamide Traditional Name: 2-(2-bromo-4-methyl-phenoxy)-N-(cetylthiocarbamoyl)acetamide Formula: C26H43BrN2O2S MolecularWeight: 527.60082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H43BrN2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-26(32)29-25(30)21-31-24-18-17-22(2)20-23(24)27/h17-18,20H,3-16,19,21H2,1-2H3,(H2,28,29,30,32)