SpectraBase Spectrum ID |
B1TVazayVsm |
Name |
1-(4-Chlorophenyl)-3-(3,4-dichlorophenyl)-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 |
C21H20Cl3N5O |
InChI |
InChI=1S/C21H20Cl3N5O/c22-14-5-8-16(9-6-14)29(21(30)25-15-7-10-17(23)18(24)12-15)13-20-27-26-19-4-2-1-3-11-28(19)20/h5-10,12H,1-4,11,13H2,(H,25,30) |
InChIKey |
LBVYHFOFQQNAAI-UHFFFAOYSA-N |
Molecular Weight |
464.784 g/mol |
SMILES |
N(C(N(Cc1[n]2c(CCCCC2)nn1)c1ccc(cc1)Cl)=O)c1cc(Cl)c(cc1)Cl |
SPLASH |
splash10-0079-9800000000-7c435ceaf41ab69a5f35 |
Wiley ID |
1466209 |