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ethyl [1-(3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)-3-oxopiperazin-2-yl]acetate

Catalog ID
STK794028
SMILES CCOC(=O)CC1C(=O)NCCN1c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(CC)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 C25H29N5O5S2 MW 543.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O5S2/c1-5-15(4)30-24(34)18(37-25(30)36)12-16-21(27-20-14(3)8-7-10-29(20)23(16)33)28-11-9-26-22(32)17(28)13-19(31)35-6-2/h7-8,10,12,15,17H,5-6,9,11,13H2,1-4H3,(H,26,32)/b18-12-
InChIKey
UVOSUWLLKRUOTH-PDGQHHTCSA-N
Synonyms
1025020-04-5
(1(3(3SECBUTYL4OXO2THIOXOTHIAZOLIDIN(5Z)YLIDENEMETHYL)9METHYL4OXO4HPYRIDO(12A)PYRIMIDIN2YL)3OXOPIPERAZIN2YL)ACETICACIDETHYLESTER
(Z)ethyl2(1(3((3(secbutyl)4oxo2thioxothiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
1025020045
CCC(C)N1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCNC(=O)C4CC(=O)OCC)SC1=S
CCOC(=O)CC1C(=O)NCCN1c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C(CC)C
ethyl(1(3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
ETHYL2(1(3((Z)(3BUTAN2YL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)3OXOPIPERAZIN2YL)ACETATE
ETHYL2(1(9METHYL3((3(METHYLPROPYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN2YL))3OXOPIPERAZIN2YL)ACETATE
InChI=1SC25H29N5O5S2c1515(4)3024(34)18(3725(30)36)121621(272014(3)871029(20)23(16)33)281192622(32)17(28)1319(31)3562h7810121517H5691113H214H3(H2632)b1812
MFCD03300253
ZINC000017596054
ZINC000108552478

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Available files

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