Aziprotryne
fo-501eb0c925e943fb
Identity
- Type
- Neutral molecule
- CAS
- 4658-28-0
- EC
- 225-101-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
13- 1,3,5-Triazin-2-amine, 4-azido-N-(1-methylethyl)-6-(methylthio)-
- 2-Azido-4-isopropylamino-6-methylmercapto-s-triazine
- 2-Azido-4-isopropylamino-6-methylthio-1,3,5-triazine
- 2-Azido-4-isopropylamino-6-methylthio-s-triazine
- 2-Methylthio-4-azido-6-isopropylamino-1,3,5-triazine
- 4-Azido-N-(1-methylethyl)-6-(methylthio)-1,3,5-triazin-2-amine
- 4-Azido-N-isopropyl-6-(methylthio)-1,3,5-triazin-2-amine
- Aziprotryn
- Brasoran
- CIBA C 7019
- Mesoranil
- Mezuron
- s-Triazine, 2-azido-4-(isopropylamino)-6-(methylthio)-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | AFIIBUOYKYSPKB-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H11N7S/c1-4(2)9-5-10-6(13-14-8)12-7(11-5)15-3/h4H,1-3H3,(H,9,10,11,12) |
| IUPAC name chemrof:IUPAC_name | 1,3,5-Triazin-2-amine, 4-azido-N-(1-methylethyl)-6-(methylthio)- |
| Molecular formula chemrof:molecular_formula | C7H11N7S |
| Molecular mass chemrof:molecular_mass | 225.281 |
| Monoisotopic mass chemrof:monoisotopic_mass | 225.07966, 225.079664 |
| SMILES string chemrof:smiles_string | CSc1nc(N=[N+]=[N-])nc(NC(C)C)n1 |
Known URLs
13Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=4658-28-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82221 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.022.819 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID3041615 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185330 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FB6H0KNM39 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.629F | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C19099 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C19099 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=130641 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:52 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/3032472 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q22712733 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 70eea735-a7d8-4639-8c1b-65aa04c41ea6 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 0e669c63-4cdb-4699-a531-6b0d75811541 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| e792e406-438b-4250-8392-324dc1fb9531 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 2694d0fe-fb2b-4dd2-8784-413a92a9f20f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 9976a001-c880-4459-bf47-a1a07a1d2383 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 9c9a3756-e8ca-4fd9-8855-e6de394c704a | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 6bb05902-dae7-490f-bacf-68f4dff4efb9 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| f0924d0b-4d67-477e-88d6-b028bf2441a4 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 4fb6a0c867481eead4ac015d4b5f765145af47c9 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| acf7f77b-23a7-4091-bc75-c35e7ef8189b | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 51dc8e7d-2a66-4c73-91f1-0179def08c5a | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 607d5bb2-3442-4ba9-bf6d-a69874556be8 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 8c35e80b-c086-4ce0-b211-16835143cf8f | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 3e3b3927-b7a2-4f8f-b63f-0d39fe382579 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works