Vitas-M small molecule compound

3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK880941
SMILES CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCC3(CC2)OCCO3)/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 C24H28N4O4S2 MW 500.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O4S2/c1-3-4-9-28-22(30)18(34-23(28)33)15-17-20(25-19-16(2)6-5-10-27(19)21(17)29)26-11-7-24(8-12-26)31-13-14-32-24/h5-6,10,15H,3-4,7-9,11-14H2,1-2H3/b18-15-
InChIKey
DXDJTDXNDWRGCW-SDXDJHTJSA-N
Synonyms

(5Z)3butyl5((2(14dioxa8azaspiro(45)decan8yl)9methyl4oxopyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(14dioxa8azaspiro(45)dec8yl)9methyl4Hpyrido(12a)pyrimidin4one
CCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC5(CC4)OCCO5)SC1=S
CCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCC3(CC2)OCCO3)C1=O
InChI=1SC24H28N4O4S2c13492822(30)18(3423(28)33)151720(251916(2)651027(19)21(17)29)2611724(81226)3113143224h561015H34791114H212H3b1815
MFCD18075866
ZINC000026779560
ZINC26779560

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Available files

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