| SpectraBase Spectrum ID |
7VFhsseIW4c |
| Name |
4-[(5-imino-2-isopropyl-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenyl 4-fluorobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H19FN4O4S |
| InChI |
InChI=1S/C23H19FN4O4S/c1-12(2)21-27-28-19(25)16(20(29)26-23(28)33-21)10-13-4-9-17(18(11-13)31-3)32-22(30)14-5-7-15(24)8-6-14/h4-12,25H,1-3H3/b16-10-,25-19? |
| InChIKey |
YXSYLEYWDOQPDA-IXNLWNGPSA-N |
| Molecular Weight |
466.487 g/mol |
| SMILES |
N=C1\C(C(=O)N=C2N1N=C(C(C)C)S2)=C\c1cc(OC)c(OC(c2ccc(cc2)F)=O)cc1 |
| SPLASH |
splash10-00di-4900000000-e153aa9095a9d33e4f13 |
| Synonyms |
4-Fluorobenzoic acid [4-[(Z)-(5-imino-7-oxo-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]-2-methoxyphenyl] ester
[4-[(Z)-(5-imino-7-oxo-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]-2-methoxyphenyl] 4-fluorobenzoate
[4-[(Z)-(5-imino-2-isopropyl-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]-2-methoxy-phenyl] 4-fluorobenzoate
[4-[(Z)-(5-azanylidene-7-oxidanylidene-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]-2-methoxy-phenyl] 4-fluoranylbenzoate |
| Wiley ID |
1453902 |
![benzoic acid, 4-fluoro-, 4-[(Z)-(5-imino-2-(1-methylethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenyl ester](/api/spectrum/7VFhsseIW4c/structure.png?h=300&w=458 "benzoic acid, 4-fluoro-, 4-[(Z)-(5-imino-2-(1-methylethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenyl ester")
