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CHEBI:120775 - 2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester

ChEBI IDCHEBI:120775
ChEBI Name2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester
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Last Modified9 March 2018
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FormulaC17H24N4O2S
Net Charge0
Average Mass348.472
Monoisotopic Mass348.16200
SMILESCC(C)OC(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1N
InChIInChI=1S/C17H24N4O2S/c1-11(2)23-14(22)10-24-16-20-19-15(21(16)18)12-6-8-13(9-7-12)17(3,4)5/h6-9,11H,10,18H2,1-5H3
InChIKeyNERMGOLFRVSVAQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester (CHEBI:120775) is a isopropyl ester (CHEBI:35725)
2-[[4-amino-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester (CHEBI:120775) is a triazoles (CHEBI:35727)
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