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CHEBI:94955 - 5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(phenylmethyl)sulfonyl-4-pyrimidinecarboxamide

ChEBI IDCHEBI:94955
ChEBI Name5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(phenylmethyl)sulfonyl-4-pyrimidinecarboxamide
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DownloadsMolfile
FormulaC16H14ClN5O3S2
Net Charge0
Average Mass423.907
Monoisotopic Mass423.02266
SMILESCCc1nnc(NC(=O)c2nc(S(=O)(=O)Cc3ccccc3)ncc2Cl)s1
InChIInChI=1S/C16H14ClN5O3S2/c1-2-12-21-22-15(26-12)20-14(23)13-11(17)8-18-16(19-13)27(24,25)9-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,20,22,23)
InChIKeyKQXGUMFOKFQRCK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(phenylmethyl)sulfonyl-4-pyrimidinecarboxamide (CHEBI:94955) is a pyrimidinecarboxamide (CHEBI:48438)
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LSM-6174LINCS