Account 5-{[(4-chlorophenyl)methyl]sulfanyl}-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2(7),3,5-triene-4-carbonitrile
- Catalog No. :
- ACYLLC948
- CAS No. :
- 889950-49-6
- Molecular Formula :
- C18H16ClN3S
- Molecular Weight :
- 341.87
IUPAC Name:6-((4-chlorobenzyl)thio)-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile
![5-{[(4-chlorophenyl)methyl]sulfanyl}-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2(7),3,5-triene-4-carbonitrile structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 5-{[(4-chlorophenyl)methyl]sulfanyl}-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2(7),3,5-triene-4-carbonitrile |
|---|---|
| IUPAC Name | 6-((4-chlorobenzyl)thio)-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile |
| Molecular Formula | C18H16ClN3S |
| Molecular Weight | 341.87 |
| SMILES | N#CC1=C(SCC2=CC=C(Cl)C=C2)N=C3C(CC4)CCN4C3=C1 |
| InChI Key | YDIQOOKRSFTDRO-UHFFFAOYSA-N |
| Synonym | 5-{[(4-chlorophenyl)methyl]sulfanyl}-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2(7),3,5-triene-4-carbonitrile;2H-1,4-Ethano-1,5-naphthyridine-7-carbonitrile, 6-[[(4-chlorophenyl)methyl]thio]-3,4-dihydro- |
| CAS No. | 889950-49-6 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACYLLC948 Molecular Building Block Synthetic Route
N-(4-Chlorophenyl)-2-({4-cyano-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2(7),3,5-trien-5-yl}sulfanyl)acetamide
2-({4-cyano-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2,4,6-trien-5-yl}sulfanyl)-N-(3-cyanophenyl)acetamide
2-({4-cyano-1,6-diazatricyclo[6.2.2.0^{2,7}]dodeca-2(7),3,5-trien-5-yl}sulfanyl)-N-(3,5-dichlorophenyl)acetamide