| SpectraBase Spectrum ID |
9J6UKLp0pXp |
| Name |
2-({2-ethoxy-4-[(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenoxy}methyl)benzonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H23N5O3S |
| InChI |
InChI=1S/C25H23N5O3S/c1-3-7-22-29-30-23(27)19(24(31)28-25(30)34-22)12-16-10-11-20(21(13-16)32-4-2)33-15-18-9-6-5-8-17(18)14-26/h5-6,8-13,27H,3-4,7,15H2,1-2H3/b19-12-,27-23? |
| InChIKey |
ATZUBUALOCLFSR-CMBAVNGNSA-N |
| Molecular Weight |
473.551 g/mol |
| SMILES |
N=C1\C(C(=O)N=C2N1N=C(CCC)S2)=C\c1cc(OCC)c(cc1)OCc1c(C#N)cccc1 |
| SPLASH |
splash10-014i-7900000000-ed8fe668a29851bca6cf |
| Synonyms |
2-({2-ethoxy-4-[(Z)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenoxy}methyl)benzonitrile
2-[[2-ethoxy-4-[(Z)-(5-imino-7-keto-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenoxy]methyl]benzonitrile
2-[[2-ethoxy-4-[(Z)-(5-imino-7-oxo-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenoxy]methyl]benzonitrile
2-[[4-[(Z)-(5-azanylidene-7-oxidanylidene-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]-2-ethoxy-phenoxy]methyl]benzenecarbonitrile |
| Wiley ID |
1464155 |
![benzonitrile, 2-[[2-ethoxy-4-[(Z)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenoxy]methyl]-](/api/spectrum/9J6UKLp0pXp/structure.png?h=300&w=458 "benzonitrile, 2-[[2-ethoxy-4-[(Z)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenoxy]methyl]-")
