| SpectraBase Spectrum ID |
LMMSR1cKgL1 |
| Name |
1-[(4-Benzyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethyl-2-butanone |
| CAS Registry Number |
309921-43-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23N3OS |
| InChI |
InChI=1S/C21H23N3OS/c1-21(2,3)18(25)15-26-20-23-22-19(17-12-8-5-9-13-17)24(20)14-16-10-6-4-7-11-16/h4-13H,14-15H2,1-3H3 |
| InChIKey |
GPEBLYDMGREQCZ-UHFFFAOYSA-N |
| Molecular Weight |
365.495 g/mol |
| SMILES |
c1ccc(C[n]2c(nnc2SCC(C(C)(C)C)=O)-c2ccccc2)cc1 |
| SPLASH |
splash10-0006-9321000000-6bb47a0cd5fd7f33d6f5 |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
1-[(4-benzyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethyl-butan-2-one
1-[(4-benzyl-5-phenyl-1,2,4-triazol-3-yl)thio]-3,3-dimethyl-butan-2-one
2-Butanone, 3,3-dimethyl-1-[[5-phenyl-4-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]-
3,3-Dimethyl-1-[[5-phenyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]butan-2-one
3,3-Dimethyl-1-[[5-phenyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-2-butanone |
| Wiley ID |
1432260 |
![1-[(4-Benzyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethyl-2-butanone](/api/spectrum/LMMSR1cKgL1/structure.png?h=300&w=458 "1-[(4-Benzyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethyl-2-butanone")
