Vitas-M small molecule compound

ethyl 4-{3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperazine-1-carboxylate

Catalog ID
STL363491
SMILES CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)C(=O)OCC)/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 C23H27N5O4S2 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O4S2/c1-3-5-9-28-21(30)17(34-23(28)33)15-16-19(24-18-8-6-7-10-27(18)20(16)29)25-11-13-26(14-12-25)22(31)32-4-2/h6-8,10,15H,3-5,9,11-14H2,1-2H3/b17-15-
InChIKey
PWLIYCUYWOLVDO-ICFOKQHNSA-N
Synonyms
607692-53-5
(Z)ethyl4(3((3butyl4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607692535
CCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C(=O)OCC)SC1=S
CCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)C(=O)OCC)C1=O
ETHYL4(3((3BUTYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(3((Z)(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC23H27N5O4S2c13592821(30)17(3423(28)33)151619(24188671027(18)20(16)29)25111326(141225)22(31)3242h681015H3591114H212H3b1715
MFCD03667438
ZINC000008858380
ZINC8858380

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Available files

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