(3E)-6-iodanyl-5-methylsulfanyl-3-(phenylmethylidene)-2-propan-2-ylsulfonyl-1H-isoindole

Systemtic Name: (3E)-6-iodanyl-5-methylsulfanyl-3-(phenylmethylidene)-2-propan-2-ylsulfonyl-1H-isoindole Openeye Name: (1E)-1-benzylidene-5-iodo-2-isopropylsulfonyl-6-methylsulfanyl-isoindoline CAS Name: (3E)-6-iodo-5-(methylthio)-3-(phenylmethylene)-2-propan-2-ylsulfonyl-1H-isoindole IUPAC Name: (3E)-3-benzylidene-6-iodo-5-methylsulfanyl-2-propan-2-ylsulfonyl-1H-isoindole Traditional Name: (1E)-1-benzal-5-iodo-2-isopropylsulfonyl-6-(methylthio)isoindoline Formula: C19H20INO2S2 MolecularWeight: 485.40207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)SC)I

Isomeric SMILES

CC(C)S(=O)(=O)N\1CC2=CC(=C(C=C2/C1=C\C3=CC=CC=C3)SC)I

InChI

InChI=1S/C19H20INO2S2/c1-13(2)25(22,23)21-12-15-10-17(20)19(24-3)11-16(15)18(21)9-14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3/b18-9+