| SpectraBase Spectrum ID |
Aq0C34A9e9 |
| Name |
2-[2'-(2''-Methylphenoxy)pyrimidin-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 |
C18H19N5O2 |
| InChI |
InChI=1S/C18H19N5O2/c1-13-7-4-5-8-14(13)25-17-19-11-10-15(20-17)23-18(24)22-12-6-2-3-9-16(22)21-23/h4-5,7-8,10-11H,2-3,6,9,12H2,1H3 |
| InChIKey |
JZKTVMQUXRMYNV-UHFFFAOYSA-N |
| Molecular Weight |
337.383 g/mol |
| SMILES |
C1(N(N=C2CCCCCN12)c1nc(Oc2c(C)cccc2)ncc1)=O |
| SPLASH |
splash10-009i-0349000000-f4cbf50e4c636e41a7e1 |
| Source of Spectrum |
AJ-43-1276-5 |
| Synonyms |
2-[2-(2-methylphenoxy)-4-pyrimidinyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-one
2-[2-(2-methylphenoxy)pyrimidin-4-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-one |
| Wiley ID |
1594315 |
![2-[2'-(2''-Methylphenoxy)pyrimidin-4'-yl)-6,7,8,9-tetrahydro-2H-(1,2,4)-triazolo[4,3-a]azepin-3(5H)-one](/api/spectrum/Aq0C34A9e9/structure.png?h=300&w=458 "2-[2'-(2''-Methylphenoxy)pyrimidin-4'-yl)-6,7,8,9-tetrahydro-2H-(1,2,4)-triazolo[4,3-a]azepin-3(5H)-one")
