| SpectraBase Spectrum ID |
3ZVM9CtN443 |
| Name |
(4-anilino-2,5-dihydrothiophen-3-yl)-(1-benzyl-5-chloro-triazol-4-yl)methanone |
| CAS Registry Number |
129609-39-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H17ClN4OS |
| InChI |
InChI=1S/C20H17ClN4OS/c21-20-18(23-24-25(20)11-14-7-3-1-4-8-14)19(26)16-12-27-13-17(16)22-15-9-5-2-6-10-15/h1-10,22H,11-13H2 |
| InChIKey |
RDSQAOAUIRRNIN-UHFFFAOYSA-N |
| Molecular Weight |
396.896 g/mol |
| SMILES |
N(C1=C(C(c2c([n](Cc3ccccc3)nn2)Cl)=O)CSC1)c1ccccc1 |
| SPLASH |
splash10-0006-9004000000-81324cc1c03957942a06 |
| Source of Spectrum |
Y-27-1141-14 |
| Synonyms |
(4-anilino-2,5-dihydrothiophen-3-yl)-[5-chloro-1-(phenylmethyl)-4-triazolyl]methanone
[5-chloranyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]-(4-phenylazanyl-2,5-dihydrothiophen-3-yl)methanone |
| Wiley ID |
1367358 |
