(E)-2-(2-bromanyl-5-methoxy-phenyl)-1,3-bis(4-methoxyphenyl)-3-methylsulfanyl-prop-2-en-1-one

Systemtic Name: (E)-2-(2-bromanyl-5-methoxy-phenyl)-1,3-bis(4-methoxyphenyl)-3-methylsulfanyl-prop-2-en-1-one Openeye Name: (E)-2-(2-bromo-5-methoxy-phenyl)-1,3-bis(4-methoxyphenyl)-3-methylsulfanyl-prop-2-en-1-one CAS Name: (E)-2-(2-bromo-5-methoxyphenyl)-1,3-bis(4-methoxyphenyl)-3-(methylthio)-2-propen-1-one IUPAC Name: (E)-2-(2-bromo-5-methoxyphenyl)-1,3-bis(4-methoxyphenyl)-3-methylsulfanylprop-2-en-1-one Traditional Name: (E)-2-(2-bromo-5-methoxy-phenyl)-1,3-bis(4-methoxyphenyl)-3-(methylthio)prop-2-en-1-one Formula: C25H23BrO4S MolecularWeight: 499.41672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C(C2=C(C=CC(=C2)OC)Br)C(=O)C3=CC=C(C=C3)OC)SC

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C(/C2=C(C=CC(=C2)OC)Br)\C(=O)C3=CC=C(C=C3)OC)/SC

InChI

InChI=1S/C25H23BrO4S/c1-28-18-9-5-16(6-10-18)24(27)23(21-15-20(30-3)13-14-22(21)26)25(31-4)17-7-11-19(29-2)12-8-17/h5-15H,1-4H3/b25-23+