Vitas-M small molecule compound

3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-hydroxyethyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK982849
SMILES CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)CCO)/C1=O

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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 C23H29N5O3S2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O3S2/c1-3-4-7-28-22(31)18(33-23(28)32)15-17-20(26-11-9-25(10-12-26)13-14-29)24-19-16(2)6-5-8-27(19)21(17)30/h5-6,8,15,29H,3-4,7,9-14H2,1-2H3/b18-15-
InChIKey
RHVDORURPXMBGL-SDXDJHTJSA-N
Synonyms
500146-46-3
(5Z)3BUTYL5((2(4(2HYDROXYETHYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3butyl5((2(4(2hydroxyethyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(2hydroxyethyl)piperazin1yl)9methyl4Hpyrido(12a)pyrimidin4one
3BUTYL5((2(4(2HYDROXYETHYL)PIPERAZINYL)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
500146463
CCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCN(CC4)CCO)SC1=S
CCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)CCO)C1=O
InChI=1SC23H29N5O3S2c13472822(31)18(3323(28)32)151720(2611925(101226)131429)241916(2)65827(19)21(17)30h5681529H347914H212H3b1815
MFCD03304577
ZINC000020130811
ZINC20130811

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Available files

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