Vitas-M small molecule compound

ethyl 4-{3-[(Z)-(3-ethyl-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
STK853661
SMILES CCOC(=O)N1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC

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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 C21H23N5O4S2 MW 473.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4S2/c1-3-25-19(28)15(32-21(25)31)13-14-17(22-16-7-5-6-8-26(16)18(14)27)23-9-11-24(12-10-23)20(29)30-4-2/h5-8,13H,3-4,9-12H2,1-2H3/b15-13-
InChIKey
VOFXLYCWDKKHAB-SQFISAMPSA-N
Synonyms
607692-41-1
(Z)ethyl4(3((3ethyl4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607692411
CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C(=O)OCC)SC1=S
CCOC(=O)N1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CC
ETHYL4(3((3ETHYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(3((Z)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(3((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC21H23N5O4S2c132519(28)15(3221(25)31)131417(2216756826(16)18(14)27)2391124(121023)20(29)3042h5813H34912H212H3b1513
MFCD03663036
ZINC000008858381
ZINC8858381

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Available files

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