DIOX2_006731

Molecular Formula: C39H34N2O5S


InChI: InChI=1/C39H34N2O5S/c1-25-34(24-47-35-11-4-5-20-40-35)45-39(46-36(25)29-14-12-26(23-42)13-15-29)30-18-16-28(17-19-30)31-8-6-7-27(21-31)22-41-37(43)32-9-2-3-10-33(32)38(41)44/h2-21,25,34,36,39,42H,22-24H2,1H3/t25-,34+,36+,39+/m1/s1

InChIKey: InChIKey=SWRBXKWHWUJWGS-DJJDDPKOBV
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O)CSC7=CC=CC=N7

Names:
    DIOX2_006731
    2-[[3-[4-[(2S,4S,5S,6S)-4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyridin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]isoindole-1,3-dione

Registries:
    PubChem CID 6688245
    PubChem ID 11313730