SpectraBase Spectrum ID |
B0bnn3RZdIG |
Name |
3-(3,4-dichlorophenyl)-1-phenyl-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 |
C21H21Cl2N5O |
InChI |
InChI=1S/C21H21Cl2N5O/c22-17-11-10-15(13-18(17)23)24-21(29)28(16-7-3-1-4-8-16)14-20-26-25-19-9-5-2-6-12-27(19)20/h1,3-4,7-8,10-11,13H,2,5-6,9,12,14H2,(H,24,29) |
InChIKey |
KXURMIGWWSNFBN-UHFFFAOYSA-N |
Molecular Weight |
430.339 g/mol |
SMILES |
N(C(N(Cc1[n]2c(CCCCC2)nn1)c1ccccc1)=O)c1cc(Cl)c(cc1)Cl |
SPLASH |
splash10-000i-8910000000-eeebf0158191bf9b5484 |
Wiley ID |
1466252 |