| SpectraBase Spectrum ID |
IT3QA4gSISS |
| Name |
2-[2'-Phenoxypyrimidin-4'-yl)-6,7,8,9-tetrahydro-2H-(1,2,4)-triazolo[4,3-a]azepin-3(5H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17N5O2 |
| InChI |
InChI=1S/C17H17N5O2/c23-17-21-12-6-2-5-9-15(21)20-22(17)14-10-11-18-16(19-14)24-13-7-3-1-4-8-13/h1,3-4,7-8,10-11H,2,5-6,9,12H2 |
| InChIKey |
ABIIMDOEPVRXOS-UHFFFAOYSA-N |
| Molecular Weight |
323.356 g/mol |
| SMILES |
C1(N(N=C2CCCCCN12)c1nc(Oc2ccccc2)ncc1)=O |
| SPLASH |
splash10-00di-0954000000-cec0d115afa82f6af63a |
| Source of Spectrum |
AJ-43-1276-5 |
| Synonyms |
2-(2-phenoxy-4-pyrimidinyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-one
2-(2-phenoxypyrimidin-4-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-one |
| Wiley ID |
1594316 |
![2-[2'-Phenoxypyrimidin-4'-yl)-6,7,8,9-tetrahydro-2H-(1,2,4)-triazolo[4,3-a]azepin-3(5H)-one](/api/spectrum/IT3QA4gSISS/structure.png?h=300&w=458 "2-[2'-Phenoxypyrimidin-4'-yl)-6,7,8,9-tetrahydro-2H-(1,2,4)-triazolo[4,3-a]azepin-3(5H)-one")
