| SpectraBase Spectrum ID |
JcKylvCMMJm |
| Name |
1,5-bis(3-Methyl-1-phenyl-5-oxopyrazol-4-yl)thiocarbohydrazone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.127343024 u |
| Formula |
C21H18N8O2S |
| InChI |
InChI=1S/C21H18N8O2S/c1-13-17(19(30)28(26-13)15-9-5-3-6-10-15)22-24-21(32)25-23-18-14(2)27-29(20(18)31)16-11-7-4-8-12-16/h3-12H,1-2H3,(H2,24,25,32)/b22-17-,23-18- |
| InChIKey |
REMHCQQUUMANSU-JUKYZOBSSA-N |
| Molecular Weight |
446.489 g/mol |
| SMILES |
C1(N(N=C(\C1=N/NC(N\N=C/1C(N(C2=CC=CC=C2)N=C1C)=O)=S)C)C=1C=CC=CC1)=O |
