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

Catalog ID
STK876625
SMILES COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCNC(=O)C2CC(=O)OC)/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 C22H23N5O6S2 MW 517.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O6S2/c1-32-10-9-27-21(31)15(35-22(27)34)11-13-18(24-16-5-3-4-7-26(16)20(13)30)25-8-6-23-19(29)14(25)12-17(28)33-2/h3-5,7,11,14H,6,8-10,12H2,1-2H3,(H,23,29)/b15-11-
InChIKey
PQBVFWMRZVOUCV-PTNGSMBKSA-N
Synonyms
1031301-02-6
(Z)methyl2(1(3((3(2methoxyethyl)4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
1031301026
COCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCNC(=O)C4CC(=O)OC)SC1=S
COCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCNC(=O)C2CC(=O)OC)C1=O
InChI=1SC22H23N5O6S2c1321092721(31)15(3522(27)34)111318(2416534726(16)20(13)30)25862319(29)14(25)1217(28)332h3571114H681012H212H3(H2329)b1511
methyl(1(3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
METHYL2(1(3((3(2METHOXYETHYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN2YL))3OXOPIPERAZIN2YL)ACETATE
METHYL2(1(3((Z)(3(2METHOXYETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)3OXOPIPERAZIN2YL)ACETATE
MFCD03288858
ZINC000008858010
ZINC000008858011

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Available files

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