| SpectraBase Spectrum ID |
sAiY7zedEq |
| Name |
Phthalazin-1(2H)-one, 4-(5-benzylthio-4-methyl-1,2,4-triazol-3-ylmethyl)-2-methyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.131031425 u |
| Formula |
C20H19N5OS |
| InChI |
InChI=1S/C20H19N5OS/c1-24-18(21-22-20(24)27-13-14-8-4-3-5-9-14)12-17-15-10-6-7-11-16(15)19(26)25(2)23-17/h3-11H,12-13H2,1-2H3 |
| InChIKey |
BZUVUEKKXGQVLS-UHFFFAOYSA-N |
| Molecular Weight |
377.466 g/mol |
| SMILES |
C1=CC=C(C=C1)CSC=1N(C(=NN1)CC1=NN(C)C(C=2C1=CC=CC2)=O)C |
