AIDS-145951

Molecular Formula: C33H32N2O9S


InChI: InChI=1/C33H32N2O9S/c1-18-11-13-24(14-12-18)27-15-25(23-9-7-6-8-10-23)26(16-34)33(45)35(27)32-31(43-22(5)39)30(42-21(4)38)29(41-20(3)37)28(44-32)17-40-19(2)36/h6-15,28-32H,17H2,1-5H3/t28-,29-,30-,31-,32-/m0/s1

InChIKey: InChIKey=FNTOYVOLRKEOFP-XDIGFQIYBN
SMILES: CC1=CC=C(C=C1)C2=CC(=C(C(=S)N2C3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C#N)C4=CC=CC=C4

Names:
    AIDS-145951
    AIDS145951
    NSC671810
    3-Pyridinecarbonitrile, 1,2-dihydro-6-(4-methylphenyl)-4-phenyl-1-(2,3,4,6-tetra-O-acetyl-.beta.-L-allopyranosyl)-2-thioxo-
    [(2S,3S,4S,5S,6S)-3,5-diacetyloxy-2-(acetyloxymethyl)-6-[3-cyano-6-(4-methylphenyl)-4-phenyl-2-sulfanylidene-pyridin-1-yl]oxan-4-yl] acetate

Registries:
    PubChem CID 495885
    PubChem ID 241900