| SpectraBase Spectrum ID |
BwDLSP3Mcel |
| Name |
1H-Pyrazolo[3,4-D]pyrimidin-4-amine, N-(3-chloro-4-methylphenyl)-1-(4-chlorophenyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.054800839 u |
| Formula |
C18H13Cl2N5 |
| InChI |
InChI=1S/C18H13Cl2N5/c1-11-2-5-13(8-16(11)20)24-17-15-9-23-25(18(15)22-10-21-17)14-6-3-12(19)4-7-14/h2-10H,1H3,(H,21,22,24) |
| InChIKey |
SQOASPHGMBOBMW-UHFFFAOYSA-N |
| Molecular Weight |
370.243 g/mol |
| SMILES |
N(C=1C2=C(N(N=C2)C2=CC=C(C=C2)Cl)N=CN1)C=1C=C(Cl)C(=CC1)C |
![1H-pyrazolo[3,4-d]pyrimidin-4-amine, N-(3-chloro-4-methylphenyl)-1-(4-chlorophenyl)-](/api/spectrum/BwDLSP3Mcel/structure.png?h=300&w=458 "1H-pyrazolo[3,4-d]pyrimidin-4-amine, N-(3-chloro-4-methylphenyl)-1-(4-chlorophenyl)-")
