2-[(2-bromophenyl)sulfanylmethyl]-3-oxidanyl-3-(phenylmethyl)isoindol-1-one

Systemtic Name: 2-[(2-bromophenyl)sulfanylmethyl]-3-oxidanyl-3-(phenylmethyl)isoindol-1-one Openeye Name: 3-benzyl-2-[(2-bromophenyl)sulfanylmethyl]-3-hydroxy-isoindolin-1-one CAS Name: 2-[[(2-bromophenyl)thio]methyl]-3-hydroxy-3-(phenylmethyl)-1-isoindolone IUPAC Name: 3-benzyl-2-[(2-bromophenyl)sulfanylmethyl]-3-hydroxyisoindol-1-one Traditional Name: 3-benzyl-2-[[(2-bromophenyl)thio]methyl]-3-hydroxy-isoindolin-1-one Formula: C22H18BrNO2S MolecularWeight: 440.35282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2(C3=CC=CC=C3C(=O)N2CSC4=CC=CC=C4Br)O

Isomeric SMILES

C1=CC=C(C=C1)CC2(C3=CC=CC=C3C(=O)N2CSC4=CC=CC=C4Br)O

InChI

InChI=1S/C22H18BrNO2S/c23-19-12-6-7-13-20(19)27-15-24-21(25)17-10-4-5-11-18(17)22(24,26)14-16-8-2-1-3-9-16/h1-13,26H,14-15H2