methyl (E)-4-[bis(4-methoxyphenyl)methylidene]-6-phenylsulfanyl-hex-2-enoate

Systemtic Name: methyl (E)-4-[bis(4-methoxyphenyl)methylidene]-6-phenylsulfanyl-hex-2-enoate Openeye Name: methyl (E)-4-[bis(4-methoxyphenyl)methylene]-6-phenylsulfanyl-hex-2-enoate CAS Name: (E)-4-[bis(4-methoxyphenyl)methylidene]-6-(phenylthio)-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-4-[bis(4-methoxyphenyl)methylidene]-6-phenylsulfanylhex-2-enoate Traditional Name: (2E)-5,5-bis(4-methoxyphenyl)-4-[2-(phenylthio)ethyl]penta-2,4-dienoic acid methyl ester Formula: C28H28O4S MolecularWeight: 460.58452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C(CCSC2=CC=CC=C2)C=CC(=O)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=C(CCSC2=CC=CC=C2)/C=C/C(=O)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H28O4S/c1-30-24-14-9-21(10-15-24)28(22-11-16-25(31-2)17-12-22)23(13-18-27(29)32-3)19-20-33-26-7-5-4-6-8-26/h4-18H,19-20H2,1-3H3/b18-13+