Vitas-M small molecule compound

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

Catalog ID
STK592508
SMILES CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/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 C28H31N5O2S2 MW 533.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2S2/c1-2-3-4-9-15-33-27(35)23(37-28(33)36)20-22-25(29-24-13-8-10-14-32(24)26(22)34)31-18-16-30(17-19-31)21-11-6-5-7-12-21/h5-8,10-14,20H,2-4,9,15-19H2,1H3/b23-20-
InChIKey
OOPMLYGDZQNLLJ-ATJXCDBQSA-N
Synonyms
636990-16-4
(5Z)3HEXYL5((4OXO2(4PHENYLPIPERAZIN1YL)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3hexyl5((4oxo2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
3HEXYL5((4OXO2(4PHENYLPIPERAZINYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
636990164
CCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C5=CC=CC=C5)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)C1=O
InChI=1SC28H31N5O2S2c12349153327(35)23(3728(33)36)202225(2924138101432(24)26(22)34)31181630(171931)21116571221h58101420H2491519H21H3b2320
MFCD03667817
ZINC000100870074
ZINC100870074

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Available files

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