Account 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
- Catalog No. :
- ACINIB859
- CAS No. :
- 685109-30-2
- Molecular Formula :
- C24H17ClF4N2S
- Molecular Weight :
- 476.93
IUPAC Name:3-((2-chloro-6-fluorobenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
![3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile |
|---|---|
| IUPAC Name | 3-((2-chloro-6-fluorobenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile |
| Molecular Formula | C24H17ClF4N2S |
| Molecular Weight | 476.93 |
| SMILES | N#CC1=C(SCC2=C(F)C=CC=C2Cl)N=C(C3=CC=CC(C(F)(F)F)=C3)C4=C1CCCC4 |
| InChI Key | HZJWFRQPESZEDV-UHFFFAOYSA-N |
| Synonym | 3-[(2-CHLORO-6-FLUOROBENZYL)SULFANYL]-1-[3-(TRIFLUOROMETHYL)PHENYL]-5,6,7,8-TETRAHYDRO-4-ISOQUINOLINECARBONITRILE;3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile;4-Isoquinolinecarbonitrile, 3-[[(2-chloro-6-fluorophenyl)methyl]thio]-5,6,7,8-tetrahydro-1-[3-(trifluoromethyl)phenyl]- |
| CAS No. | 685109-30-2 |
Synthetic Route by SureRoute
2. ACINIB859 Molecular Building Block Synthetic Route
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-phenyl-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile
3-{[(3-chlorophenyl)methyl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
3-((3-Methylbenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile