| SpectraBase Spectrum ID |
C3Sy9no67Vo |
| Name |
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
445.120860663 u |
| Formula |
C23H19N5O3S |
| InChI |
InChI=1S/C23H19N5O3S/c29-21(25-17-8-9-19-20(13-17)31-12-11-30-19)15-32-23-27-26-22(16-5-4-10-24-14-16)28(23)18-6-2-1-3-7-18/h1-10,13-14H,11-12,15H2,(H,25,29) |
| InChIKey |
NPSOUWWDUCSPDQ-UHFFFAOYSA-N |
| Molecular Weight |
445.497 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)C1=CN=CC=C1)C=1C=CC=CC1)=O)C1=CC=2OCCOC2C=C1 |
![N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide](/api/spectrum/C3Sy9no67Vo/structure.png?h=300&w=458 "N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide")
