![N-cyclohexyl-2-[5-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)sulfanyl-1,2,4-triazol-1-yl]acetamide](/api/spectrum/EoVnZKC73H2/structure.png?h=300&w=458 "N-cyclohexyl-2-[5-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)sulfanyl-1,2,4-triazol-1-yl]acetamide")
| SpectraBase Compound ID | 8BCFYkg5Pao |
|---|---|
| InChI | InChI=1S/C18H24N8O3S/c1-23-13-14(24(2)18(29)25(3)15(13)28)22-17(23)30-16-19-10-20-26(16)9-12(27)21-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H,21,27) |
| InChIKey | AQUWOYGMKIVQGG-UHFFFAOYSA-N |
| Mol Weight | 432.5 g/mol |
| Molecular Formula | C18H24N8O3S |
| Exact Mass | 432.169208 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EoVnZKC73H2 |
|---|---|
| Name | N-cyclohexyl-2-[5-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)sulfanyl-1,2,4-triazol-1-yl]acetamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H24N8O3S |
| InChI | InChI=1S/C18H24N8O3S/c1-23-13-14(24(2)18(29)25(3)15(13)28)22-17(23)30-16-19-10-20-26(16)9-12(27)21-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H,21,27) |
| InChIKey | AQUWOYGMKIVQGG-UHFFFAOYSA-N |
| Molecular Weight | 432.503 g/mol |
| SMILES | N(C(C[n]1c(Sc2nc3c(C(=O)N(C(N3C)=O)C)[n]2C)ncn1)=O)C1CCCCC1 |
| SPLASH | splash10-001i-5261900000-3a3d22761f0ded88a1b9 |
| Synonyms | N-cyclohexyl-2-[5-[(1,3,7-trimethyl-2,6-dioxo-8-purinyl)thio]-1,2,4-triazol-1-yl]acetamide N-cyclohexyl-2-[5-[(2,6-diketo-1,3,7-trimethyl-purin-8-yl)thio]-1,2,4-triazol-1-yl]acetamide N-cyclohexyl-2-[5-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-1,2,4-triazol-1-yl]ethanamide N-Cyclohexyl-2-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1H-1,2,4-triazol-1-yl}acetamide |
| Wiley ID | 1443789 |