(E)-2-(2-bromanyl-4,5-dimethoxy-phenyl)-3-(1-methylimidazol-2-yl)-3-methylsulfanyl-prop-2-enenitrile

Systemtic Name: (E)-2-(2-bromanyl-4,5-dimethoxy-phenyl)-3-(1-methylimidazol-2-yl)-3-methylsulfanyl-prop-2-enenitrile Openeye Name: (E)-2-(2-bromo-4,5-dimethoxy-phenyl)-3-(1-methylimidazol-2-yl)-3-methylsulfanyl-prop-2-enenitrile CAS Name: (E)-2-(2-bromo-4,5-dimethoxyphenyl)-3-(1-methyl-2-imidazolyl)-3-(methylthio)-2-propenenitrile IUPAC Name: (E)-2-(2-bromo-4,5-dimethoxyphenyl)-3-(1-methylimidazol-2-yl)-3-methylsulfanylprop-2-enenitrile Traditional Name: (E)-2-(2-bromo-4,5-dimethoxy-phenyl)-3-(1-methylimidazol-2-yl)-3-(methylthio)acrylonitrile Formula: C16H16BrN3O2S MolecularWeight: 394.28614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=C(C#N)C2=CC(=C(C=C2Br)OC)OC)SC

Isomeric SMILES

CN1C=CN=C1/C(=C(\C#N)/C2=CC(=C(C=C2Br)OC)OC)/SC

InChI

InChI=1S/C16H16BrN3O2S/c1-20-6-5-19-16(20)15(23-4)11(9-18)10-7-13(21-2)14(22-3)8-12(10)17/h5-8H,1-4H3/b15-11-