SpectraBase Spectrum ID |
JDcSswydzh3 |
Name |
N-[(2,4-Dichlorophenyl)-[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-(2-methyl-1H-indol-3-yl)ethanamine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
506.138864816 u |
Formula |
C26H24Cl2N6O |
InChI |
InChI=1S/C26H24Cl2N6O/c1-16-20(21-5-3-4-6-24(21)30-16)13-14-29-25(22-12-7-17(27)15-23(22)28)26-31-32-33-34(26)18-8-10-19(35-2)11-9-18/h3-12,15,25,29-30H,13-14H2,1-2H3 |
InChIKey |
MMJLJYXZPQGQGS-UHFFFAOYSA-N |
Molecular Weight |
507.425 g/mol |
SMILES |
C=1(N(N=NN1)C1=CC=C(C=C1)OC)C(C=1C(=CC(=CC1)Cl)Cl)NCCC1=C(NC=2C1=CC=CC2)C |