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CHEBI:111315 - 1,3-benzothiazole-6-carboxylic acid [2-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester

ChEBI IDCHEBI:111315
ChEBI Name1,3-benzothiazole-6-carboxylic acid [2-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester
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DownloadsMolfile
FormulaC20H22N2O4S
Net Charge0
Average Mass386.473
Monoisotopic Mass386.13003
SMILESCOCC(C)n1c(C)cc(C(=O)COC(=O)c2ccc3ncsc3c2)c1C
InChIInChI=1S/C20H22N2O4S/c1-12-7-16(14(3)22(12)13(2)9-25-4)18(23)10-26-20(24)15-5-6-17-19(8-15)27-11-21-17/h5-8,11,13H,9-10H2,1-4H3
InChIKeyZOILMRVXTXARLL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,3-benzothiazole-6-carboxylic acid [2-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester (CHEBI:111315) is a benzothiazoles (CHEBI:37947)
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LSM-22771LINCS