| SpectraBase Spectrum ID |
CBNDL3kWJQu |
| Name |
Ethyl 2-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-methyl-1,3-thiazole-5-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.077992792 u |
| Formula |
C17H16N2O5S |
| InChI |
InChI=1S/C17H16N2O5S/c1-3-22-16(21)15-10(2)18-17(25-15)19-14(20)7-5-11-4-6-12-13(8-11)24-9-23-12/h4-8H,3,9H2,1-2H3,(H,18,19,20)/b7-5+ |
| InChIKey |
YYELMGVNCCYURC-FNORWQNLSA-N |
| Molecular Weight |
360.384 g/mol |
| SMILES |
N(C=1SC(=C(N1)C)C(=O)OCC)C(\C=C\C=1C=C2OCOC2=CC1)=O |
![ethyl 2-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-methyl-1,3-thiazole-5-carboxylate](/api/spectrum/CBNDL3kWJQu/structure.png?h=300&w=458 "ethyl 2-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-methyl-1,3-thiazole-5-carboxylate")
