| SpectraBase Spectrum ID |
LUu6waWlAwf |
| Name |
4-[[2-azanylidene-3-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoic acid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H22N4O6S |
| InChI |
InChI=1S/C23H22N4O6S/c1-13(2-3-14-4-9-17-18(10-14)33-12-32-17)26-27-20(28)11-19(34-23(27)24)21(29)25-16-7-5-15(6-8-16)22(30)31/h4-10,19,24H,2-3,11-12H2,1H3,(H,25,29)(H,30,31)/b24-23?,26-13+ |
| InChIKey |
PNLFLOKSOHGHHY-VVZMYPQYSA-N |
| Molecular Weight |
482.511 g/mol |
| SMILES |
N(C(C1CC(N(C(S1)=N)\N=C\(CCc1cc2OCOc2cc1)C)=O)=O)c1ccc(C(=O)O)cc1 |
| SPLASH |
splash10-014s-7930000000-f64dce2bf6a78aec3cb8 |
| Synonyms |
4-[[3-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-2-imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid
4-[[3-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-2-imino-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoic acid
4-[[3-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-2-imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid
4-[[[3-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-2-imino-4-oxo-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid |
| Wiley ID |
1458936 |
![4-[[2-azanylidene-3-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoic acid](/api/spectrum/LUu6waWlAwf/structure.png?h=300&w=458 "4-[[2-azanylidene-3-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoic acid")
