3-[bis(phenylsulfanyl)methyl]-2-(phenylmethyl)-3H-isoindol-1-one

Systemtic Name: 3-[bis(phenylsulfanyl)methyl]-2-(phenylmethyl)-3H-isoindol-1-one Openeye Name: 2-benzyl-3-[bis(phenylsulfanyl)methyl]isoindolin-1-one CAS Name: 3-[bis(phenylthio)methyl]-2-(phenylmethyl)-3H-isoindol-1-one IUPAC Name: 2-benzyl-3-[bis(phenylsulfanyl)methyl]-3H-isoindol-1-one Traditional Name: 2-benzyl-3-[bis(phenylthio)methyl]isoindolin-1-one Formula: C28H23NOS2 MolecularWeight: 453.61832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)C(SC4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)C(SC4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C28H23NOS2/c30-27-25-19-11-10-18-24(25)26(29(27)20-21-12-4-1-5-13-21)28(31-22-14-6-2-7-15-22)32-23-16-8-3-9-17-23/h1-19,26,28H,20H2