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

Catalog ID
STK982827
SMILES CC(CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccccc2)/C1=O)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 C28H31N5O2S2 MW 533.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2S2/c1-20(2)11-13-33-27(35)23(37-28(33)36)18-22-25(29-24-10-6-7-12-32(24)26(22)34)31-16-14-30(15-17-31)19-21-8-4-3-5-9-21/h3-10,12,18,20H,11,13-17,19H2,1-2H3/b23-18-
InChIKey
BSMUGCBQRRZSEN-NKFKGCMQSA-N
Synonyms
488100-43-2
(5Z)5((2(4BENZYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHYLBUTYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3isopentyl2thioxothiazolidin4one
2(4benzylpiperazin1yl)3((Z)(3(3methylbutyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
3(3METHYLBUTYL)5((4OXO2(4BENZYLPIPERAZINYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
488100432
CC(C)CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)CC5=CC=CC=C5)SC1=S
CC(CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccccc2)C1=O)C
InChI=1SC28H31N5O2S2c120(2)11133327(35)23(3728(33)36)182225(292410671232(24)26(22)34)31161430(151731)19218435921h310121820H11131719H212H3b2318
MFCD03288480
ZINC000100834567
ZINC100834567

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Available files

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