CHEBI:104130 - 3-[4-(2-hydroxyethyl)-1-piperazinyl]-1-[2-(trifluoromethyl)-10-phenothiazinyl]-1-propanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[4-(2-hydroxyethyl)-1-piperazinyl]-1-[2-(trifluoromethyl)-10-phenothiazinyl]-1-propanone
ChEBI ID CHEBI:104130
Stars This entity has been manually annotated by a third party.
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Formula C22H24F3N3O2S
Net Charge 0
Average Mass 451.507
Monoisotopic Mass 451.15413
InChI InChI=1S/C22H24F3N3O2S/c23-22(24,25)16-5-6-20-18(15-16)28(17-3-1-2-4-19(17)31-20)21(30)7-8-26-9-11-27(12-10-26)13-14-29/h1-6,15,29H,7-14H2
InChIKey KRMKBOUUDPUIDK-UHFFFAOYSA-N
SMILES C1CN(CCN1CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO
ChEBI Ontology
Outgoing 3-[4-(2-hydroxyethyl)-1-piperazinyl]-1-[2-(trifluoromethyl)-10-phenothiazinyl]-1-propanone (CHEBI:104130) is a phenothiazines (CHEBI:38093)
Manual Xref Database
LSM-15488 LINCS
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