2-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-[(2R)-3-methylbutan-2-yl]ethanamide

Systemtic Name: 2-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-[(2R)-3-methylbutan-2-yl]ethanamide Openeye Name: 2-[(2-bromo-4,5-diethoxy-phenyl)methylsulfanyl]-N-[(1R)-1,2-dimethylpropyl]acetamide CAS Name: 2-[(2-bromo-4,5-diethoxyphenyl)methylthio]-N-[(2R)-3-methylbutan-2-yl]acetamide IUPAC Name: 2-[(2-bromo-4,5-diethoxyphenyl)methylsulfanyl]-N-[(2R)-3-methylbutan-2-yl]acetamide Traditional Name: 2-[(2-bromo-4,5-diethoxy-benzyl)thio]-N-[(1R)-1,2-dimethylpropyl]acetamide Formula: C18H28BrNO3S MolecularWeight: 418.38882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CSCC(=O)NC(C)C(C)C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CSCC(=O)N[C@H](C)C(C)C)Br)OCC

InChI

InChI=1S/C18H28BrNO3S/c1-6-22-16-8-14(15(19)9-17(16)23-7-2)10-24-11-18(21)20-13(5)12(3)4/h8-9,12-13H,6-7,10-11H2,1-5H3,(H,20,21)/t13-/m1/s1