SpectraBase Spectrum ID |
3x3LvMlB2wX |
Name |
Acetamide, N-[3-(2-benzothiazolyl)-4-hydroxyphenyl]-2-(2,4-dichloro-6-methylphenoxy)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
458.025868954 u |
Formula |
C22H16Cl2N2O3S |
InChI |
InChI=1S/C22H16Cl2N2O3S/c1-12-8-13(23)9-16(24)21(12)29-11-20(28)25-14-6-7-18(27)15(10-14)22-26-17-4-2-3-5-19(17)30-22/h2-10,27H,11H2,1H3,(H,25,28) |
InChIKey |
NXEUNOWMLXNIQT-UHFFFAOYSA-N |
Molecular Weight |
459.347 g/mol |
SMILES |
N(C(=O)COC=1C(=CC(=CC1C)Cl)Cl)C=1C=C(C(=CC1)O)C1=NC=2C=CC=CC2S1 |