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chlorimuron

PropertiesImage
MNX_IDMNXM1108235 Image of MNXM1108235
referencechebi:81953
formulaC13H11ClN4O6S
global charge0
mol weight386.773
InChIKeyRIUXZHMCCFLRBI-UHFFFAOYSA-N
InChIInChI=1S/C13H11ClN4O6S/c1-24-10-6-9(14)15-12(16-10)17-13(21)18-25(22,23)8-5-3-2-4-7(8)11(19)20/h2-6H,1H3,(H,19,20)(H2,15,16,17,18,21)
SMILESCOC1=NC(NC(=O)NS(=O)(=O)C2=C(C(=O)O)C=CC=C2)=NC(Cl)=C1
MNX internals
InChI (mnx)InChI=1/C13H11ClN4O6S/c1-24-10-6-9(14)15-12(16-10)17-13(21)18-25(22,23)8-5-3-2-4-7(8)11(19)20/h2-6H,1H3,(H,19,20)(H2,15,16,17,18,21) Image of MNXM1108235
SMILES (mnx)[CH3:1][O:24][C:10]1=[N:16][C:12]([N:17]=[C:13]([NH:18][S:25]([C:8]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:7]2[C:11](=[O:19])[OH:20])(=[O:22])=[O:23])[OH:21])=[N:15][C:9]([Cl:14])=[CH:6]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:81953
chebi:81953
RIUXZHMCCFLRBI-UHFFFAOYSA-N 		chlorimuron
2-(4-chloro-6-methoxypyrimidin-2-ylcarbamoylsulfamoyl)benzoic acid
2-[[[[(4-chloro-6-methoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]benzoic acid
2-{[(4-chloro-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}benzoic acid

kegg.compound:C18777
keggC:C18777
RIUXZHMCCFLRBI-UHFFFAOYSA-N 		Chlorimuron

keggC:M_C18777 		secondary/obsolete/fantasy identifier