| SpectraBase Spectrum ID |
3ZS86zHcfG8 |
| Name |
3-methylsulphanyl-6-(3-nitrophenyl)-1-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-d]pyrimidin-4-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H15N5O3S |
| InChI |
InChI=1S/C18H15N5O3S/c1-27-18-14-16(22(21-18)12-7-3-2-4-8-12)19-15(20-17(14)24)11-6-5-9-13(10-11)23(25)26/h2-10,15,19H,1H3,(H,20,24) |
| InChIKey |
LLTZLBCKAYTFKZ-UHFFFAOYSA-N |
| Molecular Weight |
381.410 g/mol |
| SMILES |
N1C(c2c([n](nc2SC)-c2ccccc2)NC1c1cc(N(=O)=O)ccc1)=O |
| SPLASH |
splash10-004i-9000000000-ae3a73ff89c5c9b3f292 |
| Source of Spectrum |
F2-45-5288-5d |
| Wiley ID |
1703589 |
![3-methylsulphanyl-6-(3-nitrophenyl)-1-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-d]pyrimidin-4-one](/api/spectrum/3ZS86zHcfG8/structure.png?h=300&w=458 "3-methylsulphanyl-6-(3-nitrophenyl)-1-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-d]pyrimidin-4-one")
