[5,6-bis(chloranyl)-1,3-dihydroisoindol-2-yl]-(5-methylsulfonyl-2-propan-2-ylsulfanyl-phenyl)methanone

Systemtic Name: [5,6-bis(chloranyl)-1,3-dihydroisoindol-2-yl]-(5-methylsulfonyl-2-propan-2-ylsulfanyl-phenyl)methanone Openeye Name: (5,6-dichloroisoindolin-2-yl)-(2-isopropylsulfanyl-5-methylsulfonyl-phenyl)methanone CAS Name: (5,6-dichloro-1,3-dihydroisoindol-2-yl)-[5-methylsulfonyl-2-(propan-2-ylthio)phenyl]methanone IUPAC Name: (5,6-dichloro-1,3-dihydroisoindol-2-yl)-(5-methylsulfonyl-2-propan-2-ylsulfanylphenyl)methanone Traditional Name: (5,6-dichloroisoindolin-2-yl)-[2-(isopropylthio)-5-mesyl-phenyl]methanone Formula: C19H19Cl2NO3S2 MolecularWeight: 444.39506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CC3=CC(=C(C=C3C2)Cl)Cl

Isomeric SMILES

CC(C)SC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CC3=CC(=C(C=C3C2)Cl)Cl

InChI

InChI=1S/C19H19Cl2NO3S2/c1-11(2)26-18-5-4-14(27(3,24)25)8-15(18)19(23)22-9-12-6-16(20)17(21)7-13(12)10-22/h4-8,11H,9-10H2,1-3H3