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CHEBI:109825 - [4-(butan-2-ylamino)-6-chloro-1,3,5-triazin-2-yl]-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]cyanamide

ChEBI IDCHEBI:109825
ChEBI Name[4-(butan-2-ylamino)-6-chloro-1,3,5-triazin-2-yl]-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]cyanamide
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DownloadsMolfile
FormulaC16H16ClN7O3S
Net Charge0
Average Mass421.870
Monoisotopic Mass421.07239
SMILESCCC(C)Nc1nc(Cl)nc(N(C#N)CN2C(=O)c3ccccc3S2(=O)=O)n1
InChIInChI=1S/C16H16ClN7O3S/c1-3-10(2)19-15-20-14(17)21-16(22-15)23(8-18)9-24-13(25)11-6-4-5-7-12(11)28(24,26)27/h4-7,10H,3,9H2,1-2H3,(H,19,20,21,22)
InChIKeyOMGBOSSCVRHNAO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
[4-(butan-2-ylamino)-6-chloro-1,3,5-triazin-2-yl]-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]cyanamide (CHEBI:109825) is a benzothiazoles (CHEBI:37947)
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