Vitas-M small molecule compound

3-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK794013
SMILES CN1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)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 C24H22FN5O2S2 MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN5O2S2/c1-27-10-12-28(13-11-27)21-18(22(31)29-9-3-2-4-20(29)26-21)14-19-23(32)30(24(33)34-19)15-16-5-7-17(25)8-6-16/h2-9,14H,10-13,15H2,1H3/b19-14-
InChIKey
MIDYEDPNWJZGGM-RGEXLXHISA-N
Synonyms
488862-04-0
(5Z)3((4FLUOROPHENYL)METHYL)5((2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(4fluorobenzyl)5((2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(4fluorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4methylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
488862040
CN1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)F
CN1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5=CC=C(C=C5)F
InChI=1SC24H22FN5O2S2c127101228(131127)2118(22(31)29932420(29)2621)141923(32)30(24(33)3419)15165717(25)8616h2914H101315H21H3b1914
MFCD03295400
ZINC000008858005
ZINC8858005

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Available files

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