AIDS-131673

Molecular Formula: C₂₁H₁₆N₆O₄S

InChI: InChI=1/C21H16N6O4S/c22-12-4-2-11(3-5-12)19(28)23-13(7-10-1-6-14-15(8-10)31-9-30-14)17-24-16-18(25-17)26-21(32)27-20(16)29/h1-8H,9,22H2,(H,23,28)(H3,24,25,26,27,29,32)/b13-7+/f/h23-24,26-27H

InChIKey: InChIKey=GUUQPBLJSNNXBS-VLFJKTFKDO
SMILES: C1OC2=C(O1)C=C(C=C2)C=C(C3=NC4=C(N3)C(=O)NC(=S)N4)NC(=O)C5=CC=C(C=C5)N

Names:
    AIDS-131673
    AIDS131673
    NSC624416
    4-Amino-N-(2-(1,3-benzodioxol-5-yl)-1-(6-hydroxy-2-mercapto-9H-purin-8-yl)vinyl)benzamide
    4-amino-N-[(E)-2-benzo[1,3]dioxol-5-yl-1-(6-oxo-2-sulfanylidene-3,7-dihydropurin-8-yl)ethenyl]benzamide

Registries:
    PubChem CID 6090955
    PubChem ID 227622