2-[(3E)-2-(2-hydroxyphenyl)-6-methylsulfanyl-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol

Systemtic Name: 2-[(3E)-2-(2-hydroxyphenyl)-6-methylsulfanyl-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol Openeye Name: 2-[(3E)-3-benzylidene-2-(2-hydroxyphenyl)-6-methylsulfanyl-isoindolin-5-yl]phenol CAS Name: 2-[(3E)-2-(2-hydroxyphenyl)-6-(methylthio)-3-(phenylmethylene)-1H-isoindol-5-yl]phenol IUPAC Name: 2-[(3E)-3-benzylidene-2-(2-hydroxyphenyl)-6-methylsulfanyl-1H-isoindol-5-yl]phenol Traditional Name: 2-[(3E)-3-benzal-2-(2-hydroxyphenyl)-6-(methylthio)isoindolin-5-yl]phenol Formula: C28H23NO2S MolecularWeight: 437.55272

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1C3=CC=CC=C3O)C(=CC4=CC=CC=C4)N(C2)C5=CC=CC=C5O

Isomeric SMILES

CSC1=CC2=C(C=C1C3=CC=CC=C3O)/C(=C\C4=CC=CC=C4)/N(C2)C5=CC=CC=C5O

InChI

InChI=1S/C28H23NO2S/c1-32-28-16-20-18-29(24-12-6-8-14-27(24)31)25(15-19-9-3-2-4-10-19)22(20)17-23(28)21-11-5-7-13-26(21)30/h2-17,30-31H,18H2,1H3/b25-15+