Vitas-M small molecule compound

[5-(4-methoxyphenyl)furan-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanethione

Catalog ID
STL004164
SMILES COc1ccc(cc1)c1ccc(o1)C(=S)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 C23H21F3N2O2S MW 446.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F3N2O2S/c1-29-19-7-5-16(6-8-19)20-9-10-21(30-20)22(31)28-13-11-27(12-14-28)18-4-2-3-17(15-18)23(24,25)26/h2-10,15H,11-14H2,1H3
InChIKey
HAPRPPPTPMZANX-UHFFFAOYSA-N
Synonyms
579439-39-7
(5(4methoxyphenyl)furan2yl)(4(3(trifluoromethyl)phenyl)piperazin1yl)methanethione
579439397
COC1=CC=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
InChI=1SC23H21F3N2O2Sc129197516(6819)2091021(3020)22(31)28131127(121428)1842317(1518)23(2425)26h21015H1114H21H3
MFCD04032409
ZINC000002395830
ZINC02395830
ZINC2395830

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.