| SpectraBase Spectrum ID |
DjkunkTLiKf |
| Name |
(Z)-Methyl 2-((Z)-3-benzyl-2-{(E)-[(E)-3-(2-methoxyphenyl)-allylidene]hydrazono}-4-oxothiazolidin-5-ylidene)acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.125277338 u |
| Formula |
C23H21N3O4S |
| InChI |
InChI=1S/C23H21N3O4S/c1-29-19-13-7-6-11-18(19)12-8-14-24-25-23-26(16-17-9-4-3-5-10-17)22(28)20(31-23)15-21(27)30-2/h3-15H,16H2,1-2H3/b12-8+,20-15-,24-14+,25-23- |
| InChIKey |
NPYIBXODEJZUSF-NLLWGKCJSA-N |
| Molecular Weight |
435.498 g/mol |
| SMILES |
C1(\C(S\C(N1CC=1C=CC=CC1)=N\N=C\C=C\C=1C(OC)=CC=CC1)=C\C(=O)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830857 |
![(Z)-Methyl 2-((Z)-3-benzyl-2-{(E)-[(E)-3-(2-methoxyphenyl)-allylidene]hydrazono}-4-oxothiazolidin-5-ylidene)acetate](/api/spectrum/DjkunkTLiKf/structure.png?h=300&w=458 "(Z)-Methyl 2-((Z)-3-benzyl-2-{(E)-[(E)-3-(2-methoxyphenyl)-allylidene]hydrazono}-4-oxothiazolidin-5-ylidene)acetate")
