Vitas-M small molecule compound

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

Catalog ID
STK794162
SMILES CCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCCC1)C

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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 C25H31N5O2S2 MW 497.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O2S2/c1-3-27-11-13-28(14-12-27)22-19(23(31)29-16-17(2)9-10-21(29)26-22)15-20-24(32)30(25(33)34-20)18-7-5-4-6-8-18/h9-10,15-16,18H,3-8,11-14H2,1-2H3/b20-15-
InChIKey
GSYHEAUQNYXBOE-HKWRFOASSA-N
Synonyms
488094-37-7
(5Z)3CYCLOHEXYL5((2(4ETHYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3cyclohexyl5((2(4ethylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4ethylpiperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
3CYCLOHEXYL5((2(4ETHYLPIPERAZINYL)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
488094377
CCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCCCC1)C
CCN1CCN(CC1)C2=C(C(=O)N3C=C(C=CC3=N2)C)C=C4C(=O)N(C(=S)S4)C5CCCCC5
InChI=1SC25H31N5O2S2c1327111328(141227)2219(23(31)291617(2)91021(29)2622)152024(32)30(25(33)3420)187546818h910151618H381114H212H3b2015
MFCD03288138
ZINC000008858075
ZINC8858075

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Available files

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