SpectraBase Spectrum ID |
HbtqvWrwEJr |
Name |
1-Ethanone, 2-[1-(1,3-benzothiazol-2-yl)-1H-pyrazol-5-yl]-1-phenyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
319.077933224 u |
Formula |
C18H13N3OS |
InChI |
InChI=1S/C18H13N3OS/c22-16(13-6-2-1-3-7-13)12-14-10-11-19-21(14)18-20-15-8-4-5-9-17(15)23-18/h1-11H,12H2 |
InChIKey |
HWAOEILYLMWKPT-UHFFFAOYSA-N |
Molecular Weight |
319.382 g/mol |
SMILES |
C1=CC=C2C(=C1)N=C(S2)N1C(=CC=N1)CC(C1=CC=CC=C1)=O |