SpectraBase Spectrum ID |
L4T2hnli89d |
Name |
3-(3-Chlorophenyl)-1-(4-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-ylmethyl)urea |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H24ClN5O2 |
InChI |
InChI=1S/C22H24ClN5O2/c1-30-19-11-9-18(10-12-19)28(22(29)24-17-7-5-6-16(23)14-17)15-21-26-25-20-8-3-2-4-13-27(20)21/h5-7,9-12,14H,2-4,8,13,15H2,1H3,(H,24,29) |
InChIKey |
XVVFAULNAMRMGI-UHFFFAOYSA-N |
Molecular Weight |
425.920 g/mol |
SMILES |
N(C(N(Cc1[n]2c(CCCCC2)nn1)c1ccc(cc1)OC)=O)c1cc(Cl)ccc1 |
SPLASH |
splash10-0uk9-9620000000-86b3f93de226d8a3a033 |
Wiley ID |
1466253 |