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

Catalog ID
STL049884
SMILES CCOC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F

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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 C27H25FN4O4S2 MW 552.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN4O4S2/c1-2-36-26(35)18-10-13-30(14-11-18)23-20(24(33)31-12-4-3-5-22(31)29-23)15-21-25(34)32(27(37)38-21)16-17-6-8-19(28)9-7-17/h3-9,12,15,18H,2,10-11,13-14,16H2,1H3/b21-15-
InChIKey
VHHRHNCWNYCNKT-QNGOZBTKSA-N
Synonyms

(Z)ethyl1(3((3(4fluorobenzyl)4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
CCOC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)F
CCOC(=O)C1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5=CC=C(C=C5)F
ETHYL1(3((3((4FLUOROPHENYL)METHYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
ETHYL1(3((Z)(3((4FLUOROPHENYL)METHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
ethyl1(3((Z)(3(4fluorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
InChI=1SC27H25FN4O4S2c123626(35)18101330(141118)2320(24(33)311243522(31)2923)152125(34)32(27(37)3821)16176819(28)9717h39121518H21011131416H21H3b2115
MFCD03664231
ZINC000097947687
ZINC97947687

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Available files

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