| SpectraBase Spectrum ID |
JsZI6vtT9Nk |
| Name |
N-(2-{2-[(1,3-Dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-3-yl}ethyl)-N'-ethylthiourea |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
413.152160792 u |
| Formula |
C20H23N5O3S |
| InChI |
InChI=1S/C20H23N5O3S/c1-4-21-19(29)22-10-9-13-12-7-5-6-8-15(12)23-16(13)11-14-17(26)24(2)20(28)25(3)18(14)27/h5-8,11,23H,4,9-10H2,1-3H3,(H2,21,22,29) |
| InChIKey |
HXDRDICGPDBLBO-UHFFFAOYSA-N |
| Molecular Weight |
413.496 g/mol |
| SMILES |
N1C=2C=CC=CC2C(CCNC(=S)NCC)=C1C=C1C(N(C)C(N(C1=O)C)=O)=O |
![N-(2-{2-[(1,3-dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-3-yl}ethyl)-N'-ethylthiourea](/api/spectrum/JsZI6vtT9Nk/structure.png?h=300&w=458 "N-(2-{2-[(1,3-dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-3-yl}ethyl)-N'-ethylthiourea")
