CHEBI:120637 - 7-[4-[4-(2-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7-[4-[4-(2-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one
ChEBI ID CHEBI:120637
Stars This entity has been manually annotated by a third party.
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Formula C23H23FN4O4S
Net Charge 0
Average Mass 470.518
Monoisotopic Mass 470.14240
InChI InChI=1S/C23H23FN4O4S/c24-16-4-1-2-5-18(16)26-8-10-27(11-9-26)21(29)6-3-7-28-22(30)15-12-19-20(32-14-31-19)13-17(15)25-23(28)33/h1-2,4-5,12-13H,3,6-11,14H2,(H,25,33)
InChIKey NNKLCXSVJNSYGL-UHFFFAOYSA-N
SMILES C1CN(CCN1C2=CC=CC=C2F)C(=O)CCCN3C(=O)C4=CC5=C(C=C4NC3=S)OCO5
ChEBI Ontology
Outgoing 7-[4-[4-(2-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one (CHEBI:120637) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-32079 LINCS
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