N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-2-(3-methylphenoxy)acetamide Formula: C16H18BrNO2S2 MolecularWeight: 400.35362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NCCSCC2=CC=C(S2)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NCCSCC2=CC=C(S2)Br

InChI

InChI=1S/C16H18BrNO2S2/c1-12-3-2-4-13(9-12)20-10-16(19)18-7-8-21-11-14-5-6-15(17)22-14/h2-6,9H,7-8,10-11H2,1H3,(H,18,19)