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

Catalog ID
STK876626
SMILES COC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(C)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 C22H23N5O5S2 MW 501.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O5S2/c1-12(2)27-21(31)15(34-22(27)33)10-13-18(24-16-6-4-5-8-26(16)20(13)30)25-9-7-23-19(29)14(25)11-17(28)32-3/h4-6,8,10,12,14H,7,9,11H2,1-3H3,(H,23,29)/b15-10-
InChIKey
QPCFMGYAJWNYAQ-GDNBJRDFSA-N
Synonyms
1025360-63-7
(Z)methyl2(1(3((3isopropyl4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
1025360637
CC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCNC(=O)C4CC(=O)OC)SC1=S
COC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)C(C)C
InChI=1SC22H23N5O5S2c112(2)2721(31)15(3422(27)33)101318(2416645826(16)20(13)30)25972319(29)14(25)1117(28)323h468101214H7911H213H3(H2329)b1510
methyl(3oxo1(4oxo3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazin2yl)acetate
METHYL2(1(3((3(METHYLETHYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN2YL))3OXOPIPERAZIN2YL)ACETATE
METHYL2(3OXO1(4OXO3((Z)(4OXO3PROPAN2YL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERAZIN2YL)ACETATE
MFCD03294288
ZINC000002194050
ZINC000008858015

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Available files

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