| SpectraBase Spectrum ID |
BdKhFwshmAg |
| Name |
(Z)-N-(2-(Allylimino)-4,9-dioxonaphtho[2,3-D]thiazol-3(2H,4H,9H)-yl)picolinamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
390.078661498 u |
| Formula |
C20H14N4O3S |
| InChI |
InChI=1S/C20H14N4O3S/c1-2-10-22-20-24(23-19(27)14-9-5-6-11-21-14)15-16(25)12-7-3-4-8-13(12)17(26)18(15)28-20/h2-9,11H,1,10H2,(H,23,27)/b22-20- |
| InChIKey |
VDJXWGPSSKZKEP-XDOYNYLZSA-N |
| Molecular Weight |
390.417 g/mol |
| SMILES |
C1(=CC=CC=N1)C(=O)NN1\C(SC2=C1C(C=1C=CC=CC1C2=O)=O)=N\CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900261 |