| SpectraBase Spectrum ID |
AVrcDfqOqTi |
| Name |
N-{2-[(6,7-Dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
526.134462296 u |
| Formula |
C25H26N4O5S2 |
| InChI |
InChI=1S/C25H26N4O5S2/c1-14-28-29-25(36-14)35-13-24(30)27-18-12-23(34-5)21(32-3)10-16(18)8-19-17-11-22(33-4)20(31-2)9-15(17)6-7-26-19/h6-7,9-12H,8,13H2,1-5H3,(H,27,30) |
| InChIKey |
UDQIKRXJCGFSQE-UHFFFAOYSA-N |
| Molecular Weight |
526.626 g/mol |
| SMILES |
COC1=CC(NC(CSC=2SC(=NN2)C)=O)=C(CC2=C3C=C(OC)C(=CC3=CC=N2)OC)C=C1OC |
![N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide](/api/spectrum/AVrcDfqOqTi/structure.png?h=300&w=458 "N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide")
