Consensus flow list

3-hydroxy-4-{[2-methoxy-5-methyl-4-(methylsulfamoyl)phenyl]diazenyl}-n-(2-oxo-2,3-dihydro-1h-benzimidazol-5-yl)-2-naphthamide

fo-8880a4a2fa537e49

Identity

Type
Neutral molecule
CAS
51920-12-8
EC
257-515-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 3-hydroxy-4-{[2-methoxy-5-methyl-4-(methylsulfamoyl)phenyl]diazenyl}-n-(2-oxo-2,3-dihydro-1h-benzimidazol-5-yl)-2-naphthamide

Alternative labels

17

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string YKGGTUUWVUHZIL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C27H24N6O6S/c1-14-10-21(22(39-3)13-23(14)40(37,38)28-2)32-33-24-17-7-5-4-6-15(17)11-18(25(24)34)26(35)29-16-8-9-19-20(12-16)31-27(36)30-19/h4-13,28,34H,1-3H3,(H,29,35)(H2,30,31,36)
IUPAC name chemrof:IUPAC_name 2-Naphthalenecarboxamide, N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-4-[2-[2-methoxy-5-methyl-4-[(methylamino)sulfonyl]phenyl]diazenyl]-
Molecular formula chemrof:molecular_formula C27H24N6O6S
Molecular mass chemrof:molecular_mass 560.592
Monoisotopic mass chemrof:monoisotopic_mass 560.147803
SMILES string chemrof:smiles_string CNS(=O)(=O)c1cc(OC)c(N=Nc2c(O)c(C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)cc3ccccc23)cc1C

Known URLs

6

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=51920-12-8 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.052.269 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2068686 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J294.946F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/104012 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q72499614 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
796aba0b-21bf-4f15-bec4-6626da1c6585 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
1d6855ce-a4a3-4d3c-82a9-e41f44e5e98d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
20c5474b-f6ed-4d85-a773-08ea424415b4 Environmental → Air → Indoor EF 3.1 kg 4
4f3b1591-4cd6-45d8-aea7-c8b671bf9641 Environmental → Air → Long-term EF 3.1 kg 0
46ee0461-cf0c-42a1-b806-abd0371e2df7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
d790fca4-d264-4d48-9713-7793e95f26a7 Environmental → Air → Unknown EF 3.1 kg 4
af4c2e48-5b77-427a-a3c8-259bfeafb3f8 Environmental → Ground → Agricultural EF 3.1 kg 4
dadda3a8-71c1-493a-a93b-bba6e42554fd Environmental → Ground → Non-agricultural EF 3.1 kg 4
6fcf294b-80f8-4b5a-93f9-dc7cf9cf6d4e Environmental → Ground → Unknown EF 3.1 kg 4
fc96d026-f037-4b8f-a0a2-1b6eeacd13e6 Environmental → Water → Long-term EF 3.1 kg 0
74427301-d17f-49ed-883f-6be71ed37b08 Environmental → Water → Ocean EF 3.1 kg 4
6f76ce9c-71e6-4eff-abf1-a3db4a43679d Environmental → Water → Surface water EF 3.1 kg 4
388d0c7c-46b3-401b-9f83-a78e66363619 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
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