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CHEBI:116545 - 6,7-dimethoxy-2-[[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-quinolinecarbonitrile

ChEBI IDCHEBI:116545
ChEBI Name6,7-dimethoxy-2-[[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-quinolinecarbonitrile
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FormulaC25H26N4O4S
Net Charge0
Average Mass478.574
Monoisotopic Mass478.16748
SMILESCOc1ccc(N2CCN(C(=O)CSc3nc4cc(OC)c(OC)cc4cc3C#N)CC2)cc1
InChIInChI=1S/C25H26N4O4S/c1-31-20-6-4-19(5-7-20)28-8-10-29(11-9-28)24(30)16-34-25-18(15-26)12-17-13-22(32-2)23(33-3)14-21(17)27-25/h4-7,12-14H,8-11,16H2,1-3H3
InChIKeyWOJRATVIFYWXPQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6,7-dimethoxy-2-[[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-quinolinecarbonitrile (CHEBI:116545) is a piperazines (CHEBI:26144)
Manual XrefsDatabases
LSM-28000LINCS