| SpectraBase Spectrum ID |
4M2JNvTV7tK |
| Name |
N-(3,5-Dichlorophenyl)-2-{[4-(2-furylmethyl)-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 |
459.032351315 u |
| Formula |
C20H15Cl2N5O2S |
| InChI |
InChI=1S/C20H15Cl2N5O2S/c21-14-7-15(22)9-16(8-14)24-18(28)12-30-20-26-25-19(13-3-1-5-23-10-13)27(20)11-17-4-2-6-29-17/h1-10H,11-12H2,(H,24,28) |
| InChIKey |
UDOSMYZZOYSCJP-UHFFFAOYSA-N |
| Molecular Weight |
460.339 g/mol |
| SMILES |
N(C1=CC(Cl)=CC(=C1)Cl)C(CSC=1N(C(=NN1)C=1C=NC=CC1)CC=1OC=CC1)=O |