Consensus flow list

2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole

fo-02825c039d62c064

Identity

Type
Neutral molecule
CAS
712-68-5
EC
211-925-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string SXZZHGJWUBJKHH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H4N4O3S/c7-6-9-8-5(14-6)3-1-2-4(13-3)10(11)12/h1-2H,(H2,7,9)
IUPAC name chemrof:IUPAC_name 2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole
Molecular formula chemrof:molecular_formula C6H4N4O3S
Molecular mass chemrof:molecular_mass 212.19
Monoisotopic mass chemrof:monoisotopic_mass 212.00041, 212.000411
SMILES string chemrof:smiles_string Nc1nnc(-c2ccc([N+](=O)[O-])o2)s1

Known URLs

13

Where 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=712-68-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82286 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.842 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7020059 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=53279 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=78274 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL139005 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/4JJ4COI21V enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.943D enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19189 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19189 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/61205 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27155857 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
172ab2ef-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
08a91e70-3ddc-11dd-9dff-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e14500f3-0935-4412-9d3c-a5cd139bbe06 Environmental → Air → Indoor EF 3.1 kg 2
08a91e70-3ddc-11dd-9dfe-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9e00-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
08a91e70-3ddc-11dd-9dfd-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
fe0acd60-3ddc-11dd-ab19-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-93f6-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
fe0acd60-3ddc-11dd-ab1a-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-93f4-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-92d1-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
08a91e70-3ddc-11dd-93f3-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
08a91e70-3ddc-11dd-93f5-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON 
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