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CHEBI:120845 - 2-(5-chloro-2-pyridinyl)-4-[[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione

ChEBI IDCHEBI:120845
ChEBI Name2-(5-chloro-2-pyridinyl)-4-[[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione
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FormulaC19H14ClN5O2S
Net Charge0
Average Mass411.874
Monoisotopic Mass411.05567
SMILESCCc1nnc(NC=C2C(=O)N(c3ccc(Cl)cn3)C(=O)c3ccccc32)s1
InChIInChI=1S/C19H14ClN5O2S/c1-2-16-23-24-19(28-16)22-10-14-12-5-3-4-6-13(12)17(26)25(18(14)27)15-8-7-11(20)9-21-15/h3-10H,2H2,1H3,(H,22,24)
InChIKeyDUIWPEYJHHGEAF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(5-chloro-2-pyridinyl)-4-[[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene]isoquinoline-1,3-dione (CHEBI:120845) is a isoquinolines (CHEBI:24922)
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