| SpectraBase Spectrum ID |
8kMT19Jlz5R |
| Name |
2-(Benzylsulfanyl)-5-hexyl-6-hydroxy-4(3H)-pyrimidinone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22N2O2S |
| InChI |
InChI=1S/C17H22N2O2S/c1-2-3-4-8-11-14-15(20)18-17(19-16(14)21)22-12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3,(H2,18,19,20,21) |
| InChIKey |
XKMHGSJQFQDQDH-UHFFFAOYSA-N |
| Molecular Weight |
318.435 g/mol |
| SMILES |
N1C(C(=C(N=C1SCc1ccccc1)O)CCCCCC)=O |
| SPLASH |
splash10-00kf-9111000000-4529047d79e9082d8ed4 |
| Source of Spectrum |
NP-11-1130-0 |
| Synonyms |
2-Benzylthio-5-hexyl-6-hydroxy-3H-pyrimidin-4-one
5-Hexyl-4-hydroxy-2-(phenylmethylthio)-1H-pyrimidin-6-one
2-Benzylsulfanyl-5-hexyl-4-hydroxy-1H-pyrimidin-6-one
5-Hexyl-4-oxidanyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one |
| Wiley ID |
1109393 |
