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

Systemtic Name: 2-[(1E)-2-iodanyl-6-methylsulfanyl-1-(phenylmethylidene)-3H-isoindol-5-yl]phenol Openeye Name: 2-[(1E)-1-benzylidene-2-iodo-6-methylsulfanyl-isoindolin-5-yl]phenol CAS Name: 2-[(1E)-2-iodo-6-(methylthio)-1-(phenylmethylene)-3H-isoindol-5-yl]phenol IUPAC Name: 2-[(1E)-1-benzylidene-2-iodo-6-methylsulfanyl-3H-isoindol-5-yl]phenol Traditional Name: 2-[(1E)-1-benzal-2-iodo-6-(methylthio)isoindolin-5-yl]phenol Formula: C22H18INOS MolecularWeight: 471.35389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(CN(C2=CC3=CC=CC=C3)I)C=C1C4=CC=CC=C4O

Isomeric SMILES

CSC1=CC\2=C(CN(/C2=C/C3=CC=CC=C3)I)C=C1C4=CC=CC=C4O

InChI

InChI=1S/C22H18INOS/c1-26-22-13-18-16(12-19(22)17-9-5-6-10-21(17)25)14-24(23)20(18)11-15-7-3-2-4-8-15/h2-13,25H,14H2,1H3/b20-11+