Vitas-M small molecule compound
3-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(4-fluorophenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881722
SMILES CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccc(cc2)F)/C1=O
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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 C25H24FN5O2S2 MW 509.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN5O2S2/c1-3-30-24(33)20(35-25(30)34)15-19-22(27-21-16(2)5-4-10-31(21)23(19)32)29-13-11-28(12-14-29)18-8-6-17(26)7-9-18/h4-10,15H,3,11-14H2,1-2H3/b20-15-InChIKey
IEBXMNYHZHSMGC-HKWRFOASSA-NSynonyms
(5Z)3ETHYL5((2(4(4FLUOROPHENYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)3ethyl5((2(4(4fluorophenyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(4fluorophenyl)piperazin1yl)9methyl4Hpyrido(12a)pyrimidin4one
CCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCN(CC4)C5=CC=C(C=C5)F)SC1=S
CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccc(cc2)F)C1=O
InChI=1SC25H24FN5O2S2c133024(33)20(3525(30)34)151922(272116(2)541031(21)23(19)32)29131128(121429)188617(26)7918h41015H31114H212H3b2015
MFCD18075942
ZINC000002246993
ZINC2246993
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.