SpectraBase Spectrum ID |
JCQHjRlMwWo |
Name |
Acetamide, N-(2,6-dichlorophenyl)-2-[[6-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-2-benzothiazolyl]thio]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
512.977539036 u |
Formula |
C23H13Cl2N3O3S2 |
InChI |
InChI=1S/C23H13Cl2N3O3S2/c24-15-6-3-7-16(25)20(15)27-19(29)11-32-23-26-17-9-8-12(10-18(17)33-23)28-21(30)13-4-1-2-5-14(13)22(28)31/h1-10H,11H2,(H,27,29) |
InChIKey |
RXPMYUJCEACCBP-UHFFFAOYSA-N |
Molecular Weight |
514.401 g/mol |
SMILES |
N(C1=C(Cl)C=CC=C1Cl)C(CSC=1SC=2C=C(N3C(C=4C=CC=CC4C3=O)=O)C=CC2N1)=O |