(E)-2-(2-bromanyl-4-fluoranyl-phenyl)-3-(4-methoxyphenyl)-3-sulfanyl-prop-2-enenitrile

Systemtic Name: (E)-2-(2-bromanyl-4-fluoranyl-phenyl)-3-(4-methoxyphenyl)-3-sulfanyl-prop-2-enenitrile Openeye Name: (E)-2-(2-bromo-4-fluoro-phenyl)-3-(4-methoxyphenyl)-3-sulfanyl-prop-2-enenitrile CAS Name: (E)-2-(2-bromo-4-fluorophenyl)-3-mercapto-3-(4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2-bromo-4-fluorophenyl)-3-(4-methoxyphenyl)-3-sulfanylprop-2-enenitrile Traditional Name: (E)-2-(2-bromo-4-fluoro-phenyl)-3-mercapto-3-(4-methoxyphenyl)acrylonitrile Formula: C16H11BrFNOS MolecularWeight: 364.232043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C(C#N)C2=C(C=C(C=C2)F)Br)S

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C(\C#N)/C2=C(C=C(C=C2)F)Br)/S

InChI

InChI=1S/C16H11BrFNOS/c1-20-12-5-2-10(3-6-12)16(21)14(9-19)13-7-4-11(18)8-15(13)17/h2-8,21H,1H3/b16-14-