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simazine

PropertiesImage
MNX_IDMNXM21752 Image of MNXM21752
referencechebi:27496
formulaC7H12ClN5
global charge0
mol weight201.661
InChIKeyODCWYMIRDDJXKW-UHFFFAOYSA-N
InChIInChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)
SMILESCCNC1=NC(Cl)=NC(NCC)=N1
MNX internals
InChI (mnx)InChI=1/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13) Image of MNXM21752
SMILES (mnx)[CH3:1][CH2:3][N:9]=[C:6]1[N:11]=[C:5]([Cl:8])[NH:12][C:7](=[N:10][CH2:4][CH3:2])[NH:13]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27496
chebi:27496
ODCWYMIRDDJXKW-UHFFFAOYSA-N 		simazine
2,4-bis(ethylamino)-6-chloro-1,3,5-triazine
2,4-bis(ethylamino)-6-chloro-s-triazine
2-chloro-4,6-bis(ethylamino)-1,3,5-triazine
2-chloro-4,6-bis(ethylamino)-s-triazine
6-chloro-N(2),N(4)-diethyl-1,3,5-triazine-2,4-diamine
6-chloro-N,N'-diethyl-1,3,5-triazine-2,4-diamine
6-chloro-N,N'-diethyl-[1,3,5]triazin-2,4-diamine
Gesatop
Princep
Simanex
Simazine

envipath:...2948f8fd4843
envipathM:...2948f8fd4843
kegg.compound:C11172
keggC:C11172
ODCWYMIRDDJXKW-UHFFFAOYSA-N 		Simazine
hmdb:HMDB0258294
ODCWYMIRDDJXKW-UHFFFAOYSA-N 		Simazine
2,4-Bis(ethylamino)-6-chloro-1,3,5-triazine
2,4-Bis(ethylamino)-6-chloro-S-triazine
2-Chloro-4,6-bis(ethylamino)-1,3,5-triazine
2-Chloro-4,6-bis(ethylamino)-S-triazine
6-Chloro-N(2),N(4)-diethyl-1,3,5-triazine-2,4-diamine
6-Chloro-N,n'-diethyl-[1,3,5]triazin-2,4-diamine
Gesatop
Herbazin 50
Herbazin-50
Herbazin50
N-[4-chloro-6-(ethylimino)-1,3-dihydro-1,3,5-triazin-2-ylidene]ethanamine
N-[6-chloro-4-(ethylimino)-1,2,3,4-tetrahydro-1,3,5-triazin-2-ylidene]ethan-1-amine
Princep
Simanex

seed.compound:cpd08048
seedM:cpd08048
ODCWYMIRDDJXKW-UHFFFAOYSA-N 		Simazine
simazine

envipath:...7459150754ba
envipathM:...7459150754ba
ODCWYMIRDDJXKW-UHFFFAOYSA-N 		compound 0048281

metacyc.compound:CPD-9355
metacycM:CPD-9355
ODCWYMIRDDJXKW-UHFFFAOYSA-N 		simazine

chebi:26679
chebi:9146
keggC:M_C11172
seedM:M_cpd08048 		secondary/obsolete/fantasy identifier