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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=C2CN(C(=CC3=CC=CC=C3)C2=C1)I)SC

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=C2CN(/C(=C\C3=CC=CC=C3)/C2=C1)I)SC

InChI

InChI=1S/C19H20INO2S2/c1-13(2)25(22,23)19-11-16-15(10-18(19)24-3)12-21(20)17(16)9-14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3/b17-9-