Vitas-M small molecule compound
[4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)phenyl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Catalog ID
STL282422
SMILES O=C(c1ccc(cc1)CN1CCc2c(C1)cccc2)N1CCN(CC1)c1cccc(c1)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H28F3N3O MW 479.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28F3N3O/c29-28(30,31)25-6-3-7-26(18-25)33-14-16-34(17-15-33)27(35)23-10-8-21(9-11-23)19-32-13-12-22-4-1-2-5-24(22)20-32/h1-11,18H,12-17,19-20H2InChIKey
MITOFCPPIKPOCV-UHFFFAOYSA-NSynonyms
(4(34dihydro1Hisoquinolin2ylmethyl)phenyl)(4(3(trifluoromethyl)phenyl)piperazin1yl)methanone
(4(34dihydroisoquinolin2(1H)ylmethyl)phenyl)(4(3(trifluoromethyl)phenyl)piperazin1yl)methanone
C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F
InChI=1SC28H28F3N3Oc2928(3031)2563726(1825)33141634(171533)27(35)2310821(91123)1932131222412524(22)2032h11118H12171920H2
MFCD09440707
ZINC000020567867
ZINC20567867
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