NSC76520

Molecular Formula: C31H21Cl3N4O7S


InChI: InChI=1/C31H21Cl3N4O7S/c32-19-7-1-16(2-8-19)29(39)42-13-22-24(44-30(40)17-3-9-20(33)10-4-17)25(45-31(41)18-5-11-21(34)12-6-18)28(43-22)38-15-37-23-26(38)35-14-36-27(23)46/h1-12,14-15,22,24-25,28H,13H2,(H,35,36,46)/f/h35H

InChIKey: InChIKey=DKYJVKPWLJFJEE-CSKMVECVCB
SMILES: C1=CC(=CC=C1C(=O)OCC2C(C(C(O2)N3C=NC4=C3NC=NC4=S)OC(=O)C5=CC=C(C=C5)Cl)OC(=O)C6=CC=C(C=C6)Cl)Cl

Names:
    Inosine, 6-thio-, 2',3',5'-tris (4-chlorobenzoate)
    NSC76520
    9H-Purine-6-thiol, 9-.beta.-D-ribofuranosyl-, 2',3', 5'-tris (p-chlorobenzoate)
    [4-(4-chlorobenzoyl)oxy-5-[(4-chlorobenzoyl)oxymethyl]-2-(6-sulfanylidene-3H-purin-9-yl)oxolan-3-yl] 4-chlorobenzoate

Registries:
    PubChem CID 4013945
    PubChem ID 117687