| SpectraBase Spectrum ID |
JE1rbjSBKGp |
| Name |
3,3-Dimethyl-1-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-4H-isoquinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18F3N3S2 |
| InChI |
InChI=1S/C21H18F3N3S2/c1-20(2)11-13-6-3-4-7-14(13)16(27-20)12-29-19-25-15(17-8-5-9-28-17)10-18(26-19)21(22,23)24/h3-10H,11-12H2,1-2H3 |
| InChIKey |
RIFKKECPBZWCLB-UHFFFAOYSA-N |
| Molecular Weight |
433.511 g/mol |
| SMILES |
c1cc2C(=NC(Cc2cc1)(C)C)CSc1nc(C(F)(F)F)cc(n1)-c1sccc1 |
| SPLASH |
splash10-00di-2900000000-534f9d3e2e1f5d26da48 |
| Synonyms |
3,3-Dimethyl-1-[[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-4H-isoquinoline
3,3-Dimethyl-1-[[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]-4H-isoquinoline
3,3-Dimethyl-1-[[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-4H-isoquinoline |
| Wiley ID |
1442119 |
![3,3-Dimethyl-1-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-4H-isoquinoline](/api/spectrum/JE1rbjSBKGp/structure.png?h=300&w=458 "3,3-Dimethyl-1-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-4H-isoquinoline")
