2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide

Systemtic Name: 2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-N-[2-(4-methylphenyl)sulfanylethyl]ethanamide Openeye Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-[2-[(4-methylphenyl)thio]ethyl]acetamide IUPAC Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-[2-(4-methylphenyl)sulfanylethyl]acetamide Traditional Name: 2-(4-bromo-2-methylol-phenoxy)-N-[2-(p-tolylthio)ethyl]acetamide Formula: C18H20BrNO3S MolecularWeight: 410.3253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC2=C(C=C(C=C2)Br)CO

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC2=C(C=C(C=C2)Br)CO

InChI

InChI=1S/C18H20BrNO3S/c1-13-2-5-16(6-3-13)24-9-8-20-18(22)12-23-17-7-4-15(19)10-14(17)11-21/h2-7,10,21H,8-9,11-12H2,1H3,(H,20,22)