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CHEBI:131233 - 5-[(carbamimidoylthio)methyl]-2-(3-methylbutoxy)benzoic acid methyl ester

ChEBI IDCHEBI:131233
ChEBI Name5-[(carbamimidoylthio)methyl]-2-(3-methylbutoxy)benzoic acid methyl ester
Stars
DownloadsMolfile
FormulaC15H22N2O3S
Net Charge0
Average Mass310.419
Monoisotopic Mass310.13511
SMILESCOC(=O)c1cc(CSC(=N)N)ccc1OCCC(C)C
InChIInChI=1S/C15H22N2O3S/c1-10(2)6-7-20-13-5-4-11(9-21-15(16)17)8-12(13)14(18)19-3/h4-5,8,10H,6-7,9H2,1-3H3,(H3,16,17)
InChIKeyKTRMCWILXYBTEP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-[(carbamimidoylthio)methyl]-2-(3-methylbutoxy)benzoic acid methyl ester (CHEBI:131233) is a benzoate ester (CHEBI:36054)
Manual XrefsDatabases
LSM-15344LINCS