Vitas-M small molecule compound

3-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK703914
SMILES CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/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)14-17-22(27-21-9-8-16(2)15-31(21)23(17)32)29-12-10-28(11-13-29)19-7-5-4-6-18(19)26/h4-9,14-15H,3,10-13H2,1-2H3/b20-14-
InChIKey
JIODCCTYNQGEAJ-ZHZULCJRSA-N
Synonyms
617675-26-0
(5Z)3ETHYL5((2(4(2FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3ethyl5((2(4(2fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(2fluorophenyl)piperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
617675260
CCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)C5=CC=CC=C5F)SC1=S
CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)C1=O
InChI=1SC25H24FN5O2S2c133024(33)20(3525(30)34)141722(27219816(2)1531(21)23(17)32)29121028(111329)19754618(19)26h491415H31013H212H3b2014
MFCD03663974
ZINC000001451393
ZINC1451393

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Available files

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