1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline; 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propane-1-sulfonic acid

Molecular Formula: C30H35N5O9S


InChI: InChI=1/C20H21NO4.C10H14N4O5S/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16;1-12-8-7(9(15)13(2)10(12)16)14(6-11-8)4-3-5-20(17,18)19/h5-8,10-12H,9H2,1-4H3;6H,3-5H2,1-2H3,(H,17,18,19)/f/h;17H

InChIKey: InChIKey=SMKJPZGXRDEGNE-CXCLBERRCJ
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCS(=O)(=O)O.COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC

Names:
    1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline; 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propane-1-sulfonic acid

Registries:
    PubChem CID 204805
    PubChem ID 10266439