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

Catalog ID
STL363482
SMILES CCOC(=O)N1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)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 C27H27N5O4S2 MW 549.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4S2/c1-3-36-26(35)30-15-13-29(14-16-30)23-20(24(33)31-12-8-7-11-22(31)28-23)17-21-25(34)32(27(37)38-21)18(2)19-9-5-4-6-10-19/h4-12,17-18H,3,13-16H2,1-2H3/b21-17-
InChIKey
AIIYYEQKUIEHBS-FXBPSFAMSA-N
Synonyms
607693-08-3
(Z)ethyl4(4oxo3((4oxo3(1phenylethyl)2thioxothiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607693083
CCOC(=O)N1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)C(c1ccccc1)C
CCOC(=O)N1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)C(C)C5=CC=CC=C5
ETHYL4(4OXO3((4OXO3(PHENYLETHYL)2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(4OXO3((Z)(4OXO3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(4oxo3((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC27H27N5O4S2c133626(35)30151329(141630)2320(24(33)3112871122(31)2823)172125(34)32(27(37)3821)18(2)1995461019h4121718H31316H212H3b2117
MFCD03662804
ZINC000100863838
ZINC000100863841

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Available files

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