| SpectraBase Spectrum ID |
HjszHmmaYSa |
| Name |
Methyl 4-[2-(2-(Pivaloylamino)-4(3H)-oxo-5,6-dihydro-7-tosyl-7(H)-pyrrolo[2,3-d]pyrimidin-6-yl)ethyl]benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H32N4O6S |
| InChI |
InChI=1S/C28H32N4O6S/c1-4-5-6-24(33)29-28-30-25-23(26(34)31-28)17-21(14-11-19-9-12-20(13-10-19)27(35)38-3)32(25)39(36,37)22-15-7-18(2)8-16-22/h7-10,12-13,15-16,21H,4-6,11,14,17H2,1-3H3,(H2,29,30,31,33,34) |
| InChIKey |
GIIAKWNOVFCDRN-UHFFFAOYSA-N |
| Molecular Weight |
552.646 g/mol |
| SMILES |
N1C(C=2CC(N(C2N=C1NC(=O)CCCC)S(c1ccc(cc1)C)(=O)=O)CCc1ccc(C(=O)OC)cc1)=O |
| SPLASH |
splash10-0f79-0291040000-6b338dbe93db3b7b503b |
| Source of Spectrum |
J-61-1265-20 |
| Synonyms |
Methyl 4-{2-[7-[(4-methylphenyl)sulfonyl]-4-oxo-2-(pentanoylamino)-4,5,6,7-tetrahydro-3H-pyrrolo[2,3-d]pyrimidin-6-yl]ethyl}benzoate |
| Wiley ID |
1405928 |
![Methyl 4-[2-(2-(Pivaloylamino)-4(3H)-oxo-5,6-dihydro-7-tosyl-7(H)-pyrrolo[2,3-d]pyrimidin-6-yl)ethyl]benzoate](/api/spectrum/HjszHmmaYSa/structure.png?h=300&w=458 "Methyl 4-[2-(2-(Pivaloylamino)-4(3H)-oxo-5,6-dihydro-7-tosyl-7(H)-pyrrolo[2,3-d]pyrimidin-6-yl)ethyl]benzoate")
