| SpectraBase Spectrum ID |
E6WcsPmXXH5 |
| Name |
2-(1,3-benzothiazol-2-yl)-2-(9-tetrahydropyran-2-ylpurin-6-yl)acetic acid ethyl ester |
| CAS Registry Number |
128032-96-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21N5O3S |
| InChI |
InChI=1S/C21H21N5O3S/c1-2-28-21(27)16(20-25-13-7-3-4-8-14(13)30-20)17-18-19(23-11-22-17)26(12-24-18)15-9-5-6-10-29-15/h3-4,7-8,11-12,15-16H,2,5-6,9-10H2,1H3 |
| InChIKey |
YLRIVBNDWDVGPV-UHFFFAOYSA-N |
| Molecular Weight |
423.491 g/mol |
| SMILES |
c12[n](cnc2c(C(c2nc3ccccc3s2)C(=O)OCC)ncn1)C1OCCCC1 |
| SPLASH |
splash10-014i-1094100000-c528e4d225ace29810b3 |
| Source of Spectrum |
Y-26-1521-4 |
| Synonyms |
2-(1,3-benzothiazol-2-yl)-2-[9-(2-oxanyl)-6-purinyl]acetic acid ethyl ester
Ethyl 2-(1,3-benzothiazol-2-yl)-2-(9-tetrahydropyran-2-ylpurin-6-yl)acetate
Ethyl 2-(1,3-benzothiazol-2-yl)-2-[9-(oxan-2-yl)purin-6-yl]acetate
Ethyl 2-(1,3-benzothiazol-2-yl)-2-[9-(oxan-2-yl)purin-6-yl]ethanoate |
| Wiley ID |
1378920 |
