Vitas-M small molecule compound

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

Catalog ID
STK982829
SMILES CC(CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)C)/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 C22H27N5O2S2 MW 457.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2S2/c1-15(2)7-9-27-21(29)17(31-22(27)30)14-16-19(25-12-10-24(3)11-13-25)23-18-6-4-5-8-26(18)20(16)28/h4-6,8,14-15H,7,9-13H2,1-3H3/b17-14-
InChIKey
PPXXZXGFPZVQFM-VKAVYKQESA-N
Synonyms
496774-81-3
(5Z)3(3METHYLBUTYL)5((2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3isopentyl5((2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(3methylbutyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4methylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
3(3METHYLBUTYL)5((2(4METHYLPIPERAZINYL)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
496774813
CC(C)CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C)SC1=S
CC(CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)C)C1=O)C
InChI=1SC22H27N5O2S2c115(2)792721(29)17(3122(27)30)141619(25121024(3)111325)2318645826(18)20(16)28h4681415H7913H213H3b1714
MFCD03298709
ZINC000001481304
ZINC1481304

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Available files

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