(Z)-2-(2-bromanyl-5-methoxy-phenyl)-3-methylsulfanyl-3-phenyl-prop-2-enenitrile

Systemtic Name: (Z)-2-(2-bromanyl-5-methoxy-phenyl)-3-methylsulfanyl-3-phenyl-prop-2-enenitrile Openeye Name: (Z)-2-(2-bromo-5-methoxy-phenyl)-3-methylsulfanyl-3-phenyl-prop-2-enenitrile CAS Name: (Z)-2-(2-bromo-5-methoxyphenyl)-3-(methylthio)-3-phenyl-2-propenenitrile IUPAC Name: (Z)-2-(2-bromo-5-methoxyphenyl)-3-methylsulfanyl-3-phenylprop-2-enenitrile Traditional Name: (Z)-2-(2-bromo-5-methoxy-phenyl)-3-(methylthio)-3-phenyl-acrylonitrile Formula: C17H14BrNOS MolecularWeight: 360.26816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=C(C2=CC=CC=C2)SC)C#N

Isomeric SMILES

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

InChI

InChI=1S/C17H14BrNOS/c1-20-13-8-9-16(18)14(10-13)15(11-19)17(21-2)12-6-4-3-5-7-12/h3-10H,1-2H3/b17-15+